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DeerEyeRain
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train · 715k rows

Output stringlengths 5 127	Input stringlengths 850 1.64k	Instruction stringclasses 1 value
COC(=O)[C@@H]1CNCC[C@H]1C	ir: 2 3 3 2 3 3 5 6 6 9 5 4 5 2 2 4 1 1 2 2 2 3 3 3 3 2 5 2 6 5 8 12 9 12 3 9 3 2 3 3 4 4 2 3 2 3 5 3 4 17 20 20 7 8 12 5 5 4 5 5 3 3 3 7 11 5 7 13 7 5 4 3 2 3 3 2 3 1 1 1 1 1 1 1 1 1 0 0 1 1 1 1 2 1 2 3 7 3 2 3 3 4 3 6 6 6 4 4 3 4 13 32 35 16 15 33 43 28 2 9 8 3 1 4 8 6 3 7 7 6 4 6 13 11 8 5 5 2 2 2 7 3 4 32 29 23 3 5 4 1 1 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 2 1 1 2 1 1 2 2 2 2 3 4 4 2 5 3 2 1 1 2 1 1 1 2 1 1 1 2 1 1 3 4 4 3 13 29 93 100 57 13 10 5 2 2 1 2 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 36 36 s 2H \| 31 31 ddd 1H J 29 51 126 \| 29 28 m 2H \| 28 27 dddd 1H J 31 41 59 132 \| 25 24 ddd 1H J 29 57 86 \| 24 23 tt 1H J 42 51 \| 20 19 m 1H \| 18 17 dddd 1H J 32 43 59 134 \| 15 14 dddd 1H J 32 59 71 134 \| 10 9 d 3H J 75	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C1Nc2ccc(S(=O)(=O)NCc3ccccc3)cc2C1=O	ir: 1 2 1 2 2 1 1 2 1 1 1 2 4 20 15 3 6 2 1 3 1 1 1 1 1 1 0 1 1 3 11 9 5 11 2 1 1 2 3 3 4 6 2 6 1 1 1 1 2 1 4 2 6 6 4 3 1 1 2 2 1 1 1 2 2 3 2 7 4 2 2 19 3 2 1 2 1 1 3 1 1 10 2 1 7 17 7 2 7 5 1 1 1 2 1 1 2 3 16 2 5 4 4 13 13 13 8 3 1 1 1 1 0 1 1 1 1 1 1 1 2 4 3 8 5 1 1 1 3 4 2 1 1 1 1 7 1 1 1 1 1 1 4 20 4 2 3 2 1 1 3 10 1 4 2 1 3 17 2 1 1 11 3 0 1 0 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 1 1 1 0 0 0 0 1 1 1 4 2 8 27 14 6 1 2 1 0 1 1 0 0 1 2 0 0 1 1 1 0 4 5 100 21 1 11 11 2 0 0 1 1 1 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 86 86 d 1H J 22 \| 81 80 dd 1H J 22 79 \| 77 77 d 1H J 79 \| 74 72 m 6H \| 61 61 m 1H \| 42 41 dt 2H J 8 73	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCCCCC(=O)N1C(=O)OC[C@@H]1C(C)C	ir: 5 4 6 7 3 3 2 6 5 3 3 3 3 3 3 2 2 3 3 3 3 4 11 4 2 3 3 4 4 5 8 6 13 8 4 3 3 3 4 3 4 3 7 7 4 5 6 4 9 3 3 3 4 3 3 3 3 9 5 8 4 5 3 5 5 10 3 3 4 5 4 4 3 4 3 3 3 3 3 3 3 3 3 3 5 3 3 3 2 3 3 3 3 3 3 3 3 3 3 3 3 4 5 3 4 5 8 8 8 5 4 4 4 6 8 6 9 5 8 9 14 5 6 6 3 6 3 4 12 6 11 4 5 3 4 5 5 3 3 6 4 2 2 4 5 0 100 4 3 3 4 4 5 46 5 2 2 3 3 2 2 3 3 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 3 3 2 2 2 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 2 2 2 2 3 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 3 2 2 2 3 3 2 2 3 3 3 3 3 3 2 2 3 3 3 3 3 3 3 3 4 3 3 5 5 4 3 5 4 4 6 6 7 12 7 3 4 3 3 3 3 3 2 3 3 2 2 3 3 2 2 3 3 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2; 1HNMR: 45 44 dddp 1H J 15 44 55 84 \| 43 42 dd 1H J 38 103 \| 40 40 ddd 1H J 18 57 103 \| 28 26 qt 2H J 82 144 \| 24 23 ddtd 1H J 18 70 87 140 \| 16 15 p 2H J 82 \| 14 13 m 4H \| 13 13 m 2H \| 13 13 s 1H \| 13 12 m 1H \| 9 8 m 9H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cccc(-c2ccc3c(c2)C(CSCCc2ccccc2)=CC(C)(C)N3)c1OC	ir: 4 5 3 2 5 3 1 2 6 10 7 5 4 3 3 5 1 1 1 1 2 1 1 1 0 1 1 1 3 5 4 2 3 1 1 2 2 31 13 14 4 8 2 3 3 2 2 15 5 8 2 2 2 3 14 36 1 1 2 1 1 0 4 5 5 2 7 3 6 8 3 3 2 2 2 6 4 5 1 0 1 1 2 5 1 1 1 1 1 20 6 2 3 2 0 2 1 6 10 3 10 41 7 2 6 4 1 1 4 1 2 2 6 3 2 1 1 1 10 3 4 2 3 7 1 2 3 2 5 2 2 3 0 2 8 19 5 4 7 100 8 2 14 9 17 1 4 1 2 0 2 7 14 5 10 4 10 5 10 1 1 0 1 1 1 20 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 3 2 1 2 2 1 1 3 1 0 1 3 5 9 15 22 22 65 21 7 5 5 3 0 2 3 1 0 1 1 0 0 1 1 1 1 1 1 1 15 12 69 18 1 3 2 0 0 1 2 0 1 2 2 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 77 77 d 1H J 22 \| 74 74 dd 1H J 21 76 \| 73 73 dd 1H J 12 78 \| 73 72 m 3H \| 72 71 ddt 2H J 8 15 75 \| 71 70 t 1H J 80 \| 69 69 m 2H \| 58 57 tq 1H J 9 14 \| 42 42 s 1H \| 40 39 s 2H \| 39 39 s 2H \| 36 36 d 2H J 14 \| 29 29 m 2H \| 28 28 tq 2H J 8 61 \| 15 15 d 6H J 11	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCN(CC)CCN1COc2ccc(Cl)cc2C1=O	ir: 7 4 3 4 1 3 5 6 8 3 3 1 3 4 12 9 4 17 7 2 3 3 2 2 1 2 2 0 2 11 11 3 4 3 2 1 1 5 4 1 2 4 30 50 5 4 4 0 1 4 3 1 5 38 17 2 3 10 14 40 13 1 3 3 6 6 7 4 17 11 3 5 8 3 1 0 2 2 2 7 6 10 16 17 16 14 32 24 10 4 2 4 8 3 2 15 7 3 2 4 8 12 10 5 3 1 2 1 2 1 0 3 8 2 2 3 6 5 7 33 4 4 3 3 1 5 6 22 10 6 8 5 17 20 8 6 11 8 11 2 1 1 0 1 1 0 21 71 17 4 1 3 10 1 20 100 7 2 1 1 3 10 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 2 0 1 2 2 2 2 3 3 1 4 4 5 4 7 9 40 85 33 3 3 4 4 2 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 80 80 d 1H J 25 \| 75 74 dd 1H J 25 91 \| 71 70 d 1H J 91 \| 54 54 s 2H \| 36 36 t 2H J 53 \| 29 28 t 2H J 53 \| 26 26 q 4H J 69 \| 11 11 t 6H J 69	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(CN2C(=O)CN=C(c3ccc(F)cc3)c3cc(Cl)ccc32)cc1	ir: 2 2 2 3 1 2 4 3 6 7 4 10 18 8 2 1 3 5 11 31 12 7 1 2 7 1 2 3 3 1 3 3 10 9 2 15 2 5 13 2 4 2 2 1 2 2 2 2 7 5 11 4 16 39 36 80 27 11 6 3 4 2 5 3 2 2 2 1 4 25 3 3 22 4 4 5 1 3 1 1 1 1 1 0 2 2 4 13 4 3 1 7 2 3 1 2 3 6 9 6 6 1 1 1 2 2 6 1 2 6 16 1 2 1 2 5 1 3 3 5 4 28 2 4 4 46 17 9 3 2 1 2 2 2 6 1 1 1 2 0 5 17 3 8 2 2 4 7 76 46 38 12 6 7 5 2 2 1 1 1 1 0 9 2 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 1 1 2 2 2 1 1 0 2 3 2 4 13 14 43 100 29 10 5 12 5 2 3 2 1 1 2 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 76 76 m 2H \| 74 74 t 1H J 13 \| 74 73 d 2H J 13 \| 73 72 m 4H \| 69 68 m 2H \| 52 52 d 2H J 9 \| 43 43 s 2H \| 38 38 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1cnc(Cl)c2ccc(OC)cc12	ir: 6 6 5 8 11 17 7 4 4 3 2 3 8 5 2 2 4 5 3 2 3 3 7 41 69 3 2 13 24 6 5 4 5 3 3 11 5 3 2 2 1 1 1 2 1 1 2 3 10 6 3 4 2 2 4 29 17 11 5 6 2 1 2 3 13 9 16 38 27 10 8 3 13 6 2 2 3 2 2 1 1 1 1 1 2 3 8 2 2 2 2 3 11 9 3 3 7 8 15 12 4 2 1 2 2 9 3 2 2 2 3 4 2 2 4 3 0 36 100 16 15 5 3 4 3 2 2 3 2 3 2 2 8 46 14 13 3 2 3 10 5 3 3 3 7 57 16 4 3 2 2 2 2 3 28 6 2 9 8 7 19 75 10 3 2 2 4 7 26 7 5 3 2 1 2 2 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 2 2 3 4 5 10 6 6 54 18 15 11 3 3 2 2 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 88 88 s 1H \| 80 80 d 1H J 91 \| 78 77 d 1H J 27 \| 69 69 dd 1H J 27 90 \| 39 39 s 3H \| 38 38 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCNc1nc(N2CCN(c3ccc(C#N)cc3)CC2)nc2c1S(=O)CC2	ir: 1 1 1 3 6 3 2 2 2 5 2 1 5 2 4 39 7 2 1 3 2 6 4 9 1 20 4 4 2 4 3 5 2 19 10 13 34 14 51 45 7 28 12 11 4 2 3 3 4 5 1 1 1 2 2 18 14 8 7 4 3 6 6 1 2 4 3 3 4 3 4 1 1 1 2 3 1 1 0 0 1 1 0 1 1 3 5 1 2 9 27 2 2 1 2 5 3 3 3 4 13 6 5 2 2 6 2 1 1 2 7 22 5 10 4 2 12 4 12 3 3 7 11 3 4 5 4 4 1 1 1 2 1 1 1 1 1 5 4 17 2 1 1 2 2 6 17 24 67 96 8 13 100 88 17 5 6 3 2 0 0 1 3 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 25 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 1 1 1 2 2 3 2 2 1 1 2 1 1 8 13 10 10 30 12 3 1 1 1 1 1 1 2 2 1 1 1 2 2 1 2 2 8 9 10 28 36 6 38 27 12 5 2 1 0 1 1 2 2 1 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 75 75 m 2H \| 69 69 m 2H \| 67 67 t 1H J 41 \| 41 40 dd 4H J 52 59 \| 38 37 m 2H \| 34 33 td 2H J 41 56 \| 32 32 m 4H \| 31 30 m 2H \| 17 16 qt 2H J 56 71 \| 10 9 t 3H J 71	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=S(=O)(NC1CCc2c(CCC(O)C(F)(F)F)cccc2C1)c1ccc(F)cc1	ir: 3 3 2 4 2 2 3 3 3 7 5 10 9 5 4 2 4 1 1 1 1 2 2 1 1 2 1 1 1 1 1 2 5 2 2 3 3 1 7 9 5 9 10 6 8 12 13 9 3 3 2 6 8 58 50 0 10 8 3 1 2 1 2 2 10 28 11 1 4 8 4 1 2 5 3 7 12 6 5 4 2 13 6 6 45 3 21 46 100 23 13 6 4 9 5 9 68 16 8 12 12 15 22 39 49 20 20 6 2 4 6 6 5 7 7 3 2 8 22 8 3 5 4 16 5 5 2 2 2 2 1 1 2 1 7 6 4 5 2 3 8 5 3 3 2 11 9 2 4 11 2 2 4 1 1 1 1 6 2 1 9 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 2 3 3 2 3 3 3 1 2 6 12 8 20 28 25 11 6 2 3 2 6 40 3 3 2 1 1 1 1 2 1 1 3 7 32 17 4 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 79 78 m 2H \| 73 72 m 2H \| 70 70 m 1H \| 69 69 ddt 2H J 12 71 82 \| 56 56 d 1H J 97 \| 45 44 m 1H \| 43 42 qtd 1H J 75 85 123 \| 37 36 dp 1H J 64 97 \| 31 30 ddd 1H J 8 65 139 \| 30 29 m 1H \| 29 28 m 3H \| 28 26 dtd 1H J 9 118 145 \| 21 19 m 2H \| 19 17 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=C(CC(=O)OCC)N1CC(C)(C)C1=O	ir: 20 7 6 8 7 6 2 5 9 10 4 8 7 5 2 4 5 2 2 5 7 3 2 6 9 5 7 15 24 41 12 7 16 59 59 38 7 6 4 6 4 4 3 6 8 11 7 7 10 2 3 7 4 2 5 8 18 11 6 8 6 8 15 25 13 0 4 7 4 2 7 31 63 76 39 41 18 15 28 20 7 6 6 5 3 3 6 6 8 7 7 7 4 10 45 42 7 11 18 13 20 6 9 4 3 4 5 4 3 7 11 18 13 10 13 7 18 17 35 53 15 16 28 9 4 6 7 9 6 18 17 9 5 14 27 12 70 14 6 6 4 6 14 17 49 33 11 7 11 7 77 53 30 8 5 3 7 16 38 25 19 16 8 7 5 4 3 2 3 4 3 1 3 4 2 2 3 4 3 2 3 4 2 1 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 4 3 2 2 4 3 1 2 4 3 1 3 4 2 2 3 4 2 2 3 4 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 3 4 4 7 6 7 6 8 9 9 9 10 12 22 77 74 42 100 54 12 10 9 8 13 24 18 29 56 22 7 4 4 4 5 3 2 4 4 2 2 3 4 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 1 2 3 3 1 2 3 2 1 2 4 2 1 2 3 2 1 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 2 2 2 3 2 1; 1HNMR: 53 52 q 1H J 13 \| 50 50 q 1H J 15 \| 42 41 q 2H J 66 \| 37 37 s 2H \| 32 32 t 2H J 15 \| 13 12 t 3H J 65 \| 13 12 s 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(=O)OCc1c(Cl)cccc1N1CCc2cc(C(C)(C)C)ccc2C1=O	ir: 2 4 3 5 3 4 0 2 5 2 1 2 5 10 2 4 9 6 4 6 2 2 1 2 3 3 4 3 12 24 4 13 2 2 18 7 4 6 10 12 5 3 10 47 11 12 13 42 8 3 7 5 1 12 11 5 6 6 3 2 5 9 5 4 6 9 13 21 16 13 8 6 1 4 3 2 2 1 1 1 2 3 7 10 2 3 1 1 3 3 37 44 54 10 3 4 1 2 4 6 13 6 3 4 9 5 7 21 6 3 3 4 1 10 13 3 5 9 9 6 3 15 7 9 25 31 29 7 11 8 3 5 19 35 5 5 9 13 47 35 42 5 6 10 28 9 10 3 1 3 6 5 5 14 56 35 31 24 20 1 1 2 2 18 9 2 1 0 1 2 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 2 3 1 3 4 3 3 4 4 10 2 4 3 3 7 9 12 44 15 39 100 71 30 9 7 5 2 3 3 1 1 1 2 1 0 1 2 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 77 77 d 1H J 84 \| 73 72 m 5H \| 70 69 dd 1H J 32 56 \| 54 53 s 2H \| 40 40 t 2H J 49 \| 31 30 m 2H \| 21 21 s 3H \| 13 13 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C1C(=O)N(c2ccccc2)NC1c1ccccc1	ir: 4 1 2 1 1 3 2 4 2 4 6 4 1 1 2 1 0 2 2 1 2 1 7 6 1 3 2 2 4 7 9 4 3 5 4 0 4 6 4 9 45 37 10 7 5 3 2 4 1 1 2 5 2 2 1 1 1 2 1 1 4 8 10 9 8 7 8 17 4 9 6 2 4 2 2 1 2 2 8 1 3 3 11 8 2 2 1 2 10 4 1 1 1 2 8 14 4 4 2 6 5 3 1 1 6 6 3 8 2 2 2 3 9 6 1 2 2 1 0 2 2 2 1 2 3 2 1 7 7 9 1 2 5 4 5 10 3 8 1 2 2 1 11 16 13 10 3 3 2 2 7 6 4 7 3 2 1 1 1 2 2 1 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 1 3 3 2 2 6 20 11 17 12 12 3 3 1 1 2 1 2 2 1 1 2 3 1 2 4 12 10 100 43 2 4 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 75 74 ddd 2H J 18 34 75 \| 74 74 d 4H J 45 \| 74 73 dp 3H J 18 50 \| 73 73 dt 1H J 45 91 \| 58 58 d 1H J 44 \| 54 53 m 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)c1cn(CC)c2ncc(NC3Cc4ccccc4C3)cc2c1=O	ir: 5 3 7 6 3 6 4 3 3 2 2 2 5 2 6 5 14 12 3 6 5 6 3 3 3 1 1 3 2 3 3 3 2 1 2 3 2 2 3 3 11 15 13 4 3 5 5 28 43 23 5 4 3 1 1 3 2 0 2 4 2 1 2 2 1 8 5 4 7 4 3 3 4 3 5 5 4 2 2 2 2 1 11 3 1 1 2 4 4 2 2 3 1 2 2 2 2 5 5 3 1 2 2 2 4 21 9 7 6 11 17 10 11 3 5 7 4 6 8 4 2 3 3 5 4 4 5 4 3 2 5 15 4 3 2 2 5 8 3 13 5 5 5 12 30 54 45 100 3 14 8 11 18 10 4 8 10 6 2 1 3 7 11 41 48 4 2 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 2 1 2 2 2 1 2 2 2 1 2 3 2 1 3 7 5 5 9 27 11 3 14 4 3 2 2 3 2 2 2 2 2 1 2 2 1 2 3 3 3 9 11 27 22 15 11 7 5 3 2 2 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 2 1 0 1 2 1 0 1 2 1 0; 1HNMR: 88 87 t 1H J 9 \| 80 80 d 1H J 16 \| 78 78 d 1H J 16 \| 73 72 m 2H \| 72 71 dd 2H J 37 60 \| 67 66 d 1H J 82 \| 46 45 qd 2H J 9 83 \| 44 44 dp 1H J 50 84 \| 43 42 q 2H J 71 \| 32 31 ddd 2H J 8 49 146 \| 29 29 ddd 2H J 8 50 147 \| 14 13 t 3H J 82 \| 13 12 t 3H J 71	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(O)C1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1	ir: 1 2 1 2 5 3 4 2 2 2 1 5 12 33 25 5 4 7 12 21 30 100 85 45 7 12 4 2 2 2 3 1 1 2 2 0 2 4 2 2 1 3 1 0 1 2 3 1 1 2 1 1 3 2 11 14 2 2 1 2 3 3 3 1 1 3 7 21 9 3 2 1 3 2 3 5 11 19 25 60 9 11 3 3 5 6 7 10 4 7 17 6 8 9 1 6 9 6 89 58 5 3 1 1 3 3 4 7 3 5 10 5 21 15 15 8 8 11 3 2 2 2 2 1 2 7 12 2 3 1 1 1 2 1 1 1 2 0 0 3 3 3 6 19 16 2 3 3 2 3 17 1 2 4 1 1 1 0 0 1 1 0 3 1 0 0 0 1 0 0 0 1 0 0 1 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 2 2 1 1 1 1 1 5 3 6 10 6 8 15 15 2 2 1 1 1 2 8 46 45 8 4 1 0 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 76 75 m 2H \| 69 69 d 1H J 66 \| 37 36 ddd 2H J 59 86 123 \| 34 33 ddd 2H J 59 86 123 \| 26 25 p 1H J 58 \| 23 22 ddt 2H J 58 86 125 \| 20 19 ddt 2H J 58 86 125	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C1c2ccccc2C(O)N1CCCN1CCN(c2ccc(Cl)cc2)CC1	ir: 5 3 6 3 2 5 5 3 0 3 2 1 9 3 5 4 5 5 6 4 3 2 2 2 3 4 3 0 1 4 10 41 40 11 7 4 89 6 2 13 68 23 6 8 7 2 2 1 1 3 3 1 4 25 100 19 4 4 12 6 6 8 11 6 2 3 2 9 8 2 8 11 2 0 4 6 5 8 3 10 20 49 4 21 15 57 39 18 8 7 24 18 3 2 8 6 10 4 7 12 6 38 12 3 4 1 2 1 5 4 13 5 5 1 2 2 8 13 12 6 3 6 8 13 21 23 11 5 2 3 4 2 3 2 5 4 21 22 24 19 5 2 2 1 1 2 5 28 45 25 4 5 55 7 5 13 3 3 4 3 1 1 25 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 3 2 0 6 3 1 1 1 4 2 0 3 7 9 3 45 41 40 18 7 2 4 3 4 5 3 2 1 0 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 77 77 dt 1H J 9 84 \| 76 75 m 2H \| 75 75 m 1H \| 73 72 m 2H \| 69 68 m 2H \| 59 59 d 1H J 44 \| 55 54 d 1H J 46 \| 37 36 dt 1H J 68 123 \| 35 34 dt 1H J 68 123 \| 33 32 m 4H \| 28 27 m 4H \| 26 25 t 2H J 64 \| 19 18 m 1H \| 18 17 m 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cn1c(C(=O)NCc2ccc(Cl)cc2)cc2c(O)cccc21	ir: 3 3 3 3 4 2 2 2 3 4 4 8 12 6 5 2 4 10 2 2 4 6 22 22 10 4 3 3 2 1 1 3 3 0 4 11 4 3 8 39 23 5 5 2 3 3 5 29 12 7 5 4 5 5 29 7 4 2 2 2 1 3 6 5 2 1 1 2 11 6 2 2 1 2 5 6 8 14 5 2 2 3 3 3 2 4 10 8 18 5 4 3 1 4 15 9 2 1 2 13 2 1 2 1 1 1 1 1 1 1 2 1 0 2 2 2 1 3 2 7 5 5 6 7 14 8 12 2 1 3 7 9 2 3 2 2 15 10 2 2 12 13 32 40 40 5 8 12 3 10 7 64 100 6 2 0 1 18 4 0 6 12 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 1 1 1 1 1 1 1 1 2 1 2 3 2 1 1 2 1 1 3 5 4 7 23 22 29 11 11 3 2 2 4 8 31 2 2 2 2 1 2 1 2 2 2 3 2 3 5 15 11 35 23 3 2 2 2 2 1 1 2 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0; 1HNMR: 86 86 s 1H \| 79 79 t 1H J 52 \| 76 76 s 1H \| 73 73 dt 2H J 9 80 \| 73 72 m 3H \| 72 71 dd 1H J 64 79 \| 68 68 dt 1H J 8 79 \| 46 45 dt 2H J 8 53 \| 38 38 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=c1[nH]c(CCCCc2ccc(F)cc2)nc2ncc(Cl)cc12	ir: 1 1 1 1 1 2 2 2 1 1 2 2 1 1 1 1 2 1 1 1 1 1 4 2 1 1 1 4 5 1 1 1 2 2 3 1 1 1 1 1 2 5 5 3 2 5 5 20 66 42 4 3 5 10 2 2 28 10 5 4 2 1 1 2 1 1 1 1 2 3 1 1 1 1 1 1 1 1 1 2 4 7 1 1 1 3 3 3 1 1 1 3 1 1 3 7 6 8 8 5 1 2 1 1 1 2 4 1 1 1 1 1 3 3 4 3 3 8 6 3 1 2 2 2 3 2 1 1 1 1 1 1 3 6 1 2 1 1 1 1 1 1 2 1 3 13 15 23 10 4 3 2 2 2 2 1 1 3 2 100 59 53 11 4 2 0 1 2 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 3 2 1 1 1 2 3 7 5 20 18 10 5 3 2 3 3 1 1 1 1 1 1 1 1 2 1 1 1 2 2 3 19 18 14 17 5 4 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 86 85 d 1H J 16 \| 83 83 d 1H J 16 \| 72 71 ddt 2H J 9 35 81 \| 71 70 m 2H \| 28 28 m 2H \| 26 26 tt 2H J 9 81 \| 18 16 m 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCN(C(=O)c1ccc(F)c(F)c1)c1nc2n(c1C(=O)OCC)CCCC2	ir: 3 1 0 1 2 2 19 14 7 1 1 1 3 2 2 2 2 2 0 1 1 0 2 2 1 1 4 2 1 1 1 1 2 4 4 5 3 5 6 12 4 4 2 10 1 2 2 1 1 1 2 1 2 1 1 1 10 6 1 1 1 0 2 1 1 2 2 1 3 11 2 1 1 1 1 1 1 1 1 4 6 8 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 2 3 5 4 2 1 1 1 3 5 6 7 8 4 4 2 5 3 3 1 6 2 9 1 3 5 8 8 3 2 1 17 8 3 1 1 2 2 7 3 2 3 12 2 10 22 6 14 20 3 100 3 0 0 1 1 0 1 1 1 0 0 1 1 0 0 0 1 0 0 0 1 1 0 0 0 1 0 0 0 1 1 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 1 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 1 1 1 1 1 1 1 2 3 4 2 1 1 2 2 1 2 7 11 6 5 15 9 1 1 1 1 1 1 1 1 1 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 78 77 m 2H \| 74 73 ddd 1H J 47 95 102 \| 44 43 q 2H J 63 \| 43 42 t 2H J 73 \| 42 41 dd 2H J 50 57 \| 26 25 dd 2H J 46 56 \| 20 18 m 4H \| 18 18 p 2H J 70 \| 15 13 m 5H \| 10 10 t 3H J 74	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCCc1ccc([C@@H]2CC[C@@H](C=O)CC2)cc1	ir: 3 2 2 2 5 3 3 3 5 4 1 6 7 12 12 5 5 2 4 9 16 5 9 6 3 1 1 3 3 5 2 2 3 2 2 4 4 2 3 6 4 10 7 12 10 6 9 14 4 8 11 7 17 14 21 22 16 15 10 8 4 3 3 6 3 1 3 4 3 28 9 3 2 1 5 3 3 2 3 2 1 1 2 2 1 1 3 4 3 1 3 4 4 12 17 17 10 14 5 4 6 5 7 4 11 23 18 43 39 19 31 21 17 9 12 5 5 7 5 8 15 5 7 10 10 8 9 5 3 5 3 2 1 4 7 8 4 2 3 1 1 2 2 2 3 6 6 29 59 34 54 21 21 11 7 1 3 3 2 0 1 3 2 0 1 3 1 0 1 3 1 0 1 3 2 0 1 2 1 0 1 2 1 0 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 0 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 2 2 3 4 1 4 4 6 10 6 5 8 9 5 8 12 13 16 19 34 35 79 100 25 5 8 10 3 1 3 5 2 1 2 2 1 0 2 2 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0; 1HNMR: 96 96 dp 1H J 10 77 \| 72 71 m 2H \| 70 70 dt 2H J 9 83 \| 27 26 tt 2H J 10 75 \| 25 24 dtt 2H J 46 71 161 \| 19 18 m 4H \| 17 15 m 4H \| 15 14 p 2H J 74 \| 14 13 m 4H \| 9 9 t 3H J 67	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
c1ccc(Oc2cc(NC3=NC[C@@]4(CN5CCC4CC5)O3)ncn2)cc1	ir: 1 1 2 1 2 5 2 2 3 1 2 2 4 12 1 1 1 1 3 2 3 4 14 12 6 1 2 2 5 2 2 1 1 4 9 57 34 12 6 8 5 2 5 2 2 3 2 2 15 1 1 3 1 1 1 1 1 1 1 1 2 2 3 1 17 10 7 2 2 2 2 1 3 13 2 1 1 2 2 3 4 2 4 1 4 4 3 6 5 1 3 1 1 1 10 3 1 2 2 1 1 1 1 3 2 1 2 1 1 2 1 1 1 2 3 1 1 2 6 1 1 2 1 2 1 1 1 1 1 1 1 1 2 3 2 13 2 1 2 9 10 2 8 5 2 60 5 3 2 0 44 63 13 7 3 1 1 2 2 2 88 19 1 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 2 1 4 6 6 6 17 9 3 3 2 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 3 3 2 3 6 21 32 100 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 100 99 s 1H \| 82 82 d 1H J 14 \| 74 74 m 2H \| 72 71 dq 2H J 16 82 \| 70 70 tt 1H J 13 73 \| 56 55 d 1H J 14 \| 42 41 d 1H J 121 \| 41 40 d 1H J 121 \| 34 34 d 1H J 124 \| 32 32 d 1H J 126 \| 29 29 ddd 2H J 44 70 115 \| 29 28 ddd 2H J 44 70 116 \| 23 22 p 1H J 44 \| 19 18 ddt 2H J 44 70 125 \| 16 15 ddt 2H J 43 69 124	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCOc1ccc(N(C)C)cc1-c1ncc(-c2nnn[nH]2)c(=O)[nH]1	ir: 2 3 5 2 0 4 3 3 1 2 3 2 1 3 6 5 2 4 8 6 3 5 4 2 10 15 14 3 1 3 3 0 1 5 3 2 2 5 4 5 5 7 3 0 2 5 5 2 6 9 8 0 74 97 100 39 40 17 6 6 3 8 4 2 2 7 7 3 8 18 6 7 4 8 4 3 4 6 3 7 6 4 3 2 3 3 1 2 5 8 24 4 7 6 12 18 7 13 7 2 4 3 1 9 5 7 2 3 4 3 2 3 7 3 0 2 5 2 2 2 19 3 2 2 4 2 1 3 3 1 1 2 4 3 6 8 12 3 10 3 2 1 1 3 5 18 6 6 14 22 20 26 22 17 7 3 11 63 3 5 3 3 5 100 15 15 11 5 2 0 2 4 2 0 2 4 2 0 2 3 2 0 2 3 1 0 2 3 1 1 2 3 1 1 2 3 1 1 2 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 2 3 2 1 2 3 2 0 2 3 2 0 2 3 2 0 2 3 2 1 2 3 1 1 2 3 1 1 2 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 3 2 1 2 3 3 1 2 3 3 1 2 4 3 5 3 7 9 20 17 7 7 8 2 4 2 1 2 3 3 1 2 2 2 2 2 2 2 7 5 17 14 27 22 28 91 5 10 6 0 3 5 5 3 1 3 2 0 1 3 2 1 1 3 2 1 2 3 2 0 2 3 2 0 2 3 2 1 2 3 1 0 2 3 1 1 2 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 3 2 1 1 3 2 1 1 3 2 1 2 3 2 1 2 3; 1HNMR: 85 84 s 1H \| 76 76 d 1H J 22 \| 70 70 d 1H J 81 \| 68 68 dd 1H J 22 82 \| 42 42 t 2H J 54 \| 29 29 s 6H \| 20 19 qt 3H J 53 79 \| 11 11 t 4H J 78	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccccc1Nc1nccc2c1cnc1ccc(Br)cc12	ir: 2 1 4 13 23 27 8 3 24 6 9 2 30 2 1 2 4 13 30 3 7 3 6 7 7 50 38 61 8 12 7 3 1 18 9 2 0 3 3 2 17 9 29 20 5 5 3 1 9 4 1 1 3 5 3 5 84 4 6 9 21 2 2 3 2 8 2 2 5 2 9 5 5 21 9 7 4 2 2 4 6 14 28 9 4 5 2 1 2 3 18 3 23 1 4 22 1 23 5 1 3 11 5 2 3 2 3 2 1 11 1 1 2 1 0 5 4 12 26 6 4 1 1 1 2 1 1 1 1 3 10 2 8 4 22 16 5 30 8 2 16 8 2 1 6 68 2 13 15 12 8 28 7 28 6 17 41 11 13 17 11 7 3 24 6 1 1 4 3 100 20 2 5 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 2 2 2 3 5 6 8 23 58 46 75 13 2 3 4 2 2 2 2 3 1 1 1 1 0 3 1 1 1 4 11 10 18 27 63 54 30 7 4 2 3 2 1 1 1 1 1 1 1 1 1 0 0 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 97 96 s 1H \| 92 92 s 1H \| 83 83 d 1H J 49 \| 81 81 d 1H J 23 \| 80 80 d 1H J 82 \| 79 78 d 1H J 49 \| 77 76 dd 1H J 26 82 \| 72 72 ddd 1H J 8 16 78 \| 72 71 m 3H \| 23 22 d 3H J 7	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cn1cnc2cc(Br)cnc21	ir: 6 4 3 9 14 6 2 7 8 11 12 10 10 3 2 4 6 2 21 23 22 9 8 5 5 3 3 4 4 3 6 12 9 3 4 6 6 16 52 50 27 1 6 8 4 4 7 7 4 1 3 6 4 1 4 8 4 2 4 9 5 3 4 4 5 23 34 13 19 5 8 21 2 0 5 7 2 1 5 6 2 1 5 6 2 2 8 10 2 32 27 4 4 5 8 5 3 7 11 41 7 21 33 40 8 21 5 22 3 5 10 5 2 4 8 5 3 7 12 5 5 6 100 29 80 27 20 10 3 6 6 4 2 5 5 3 2 5 16 5 21 4 5 2 2 5 5 1 12 23 6 6 6 30 47 23 3 7 4 2 3 6 4 1 3 6 4 1 3 6 4 1 4 6 3 1 4 6 4 2 4 6 3 2 4 5 3 2 4 5 3 2 4 5 2 2 5 5 2 2 5 5 2 2 5 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 6 4 1 3 6 3 1 4 6 3 2 4 5 3 2 4 5 3 2 4 5 3 2 4 5 3 2 4 5 3 2 4 5 2 3 5 4 2 3 5 4 2 3 5 5 3 4 5 4 2 4 9 5 3 5 9 7 5 8 10 6 4 8 14 16 10 10 11 6 2 4 5 3 2 4 5 3 2 4 5 3 2 4 5 3 2 4 4 3 2 4 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 3 2 4 5 3 2 4 5 3 2 4 5 3 2 4 5 3 2 4 5 3 2 4 4 3 3 4 4 3 3 4 4 2 3 4 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 3 2; 1HNMR: 86 85 d 1H J 16 \| 83 83 d 1H J 16 \| 79 79 s 1H \| 39 39 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccccc1N(C)C(=O)c1ccc(Cl)c(-c2ccc(Cl)nc2)c1	ir: 3 5 4 8 5 5 4 3 4 6 3 7 3 4 3 4 3 4 8 3 6 3 3 3 3 7 4 4 2 4 4 3 7 5 6 27 20 7 11 11 45 32 100 31 8 3 4 5 4 3 3 5 7 18 41 54 11 2 5 5 3 3 4 7 4 4 3 4 6 33 27 13 4 4 5 8 4 4 4 4 2 3 4 4 5 7 7 4 3 5 3 3 2 2 3 3 2 3 3 3 2 3 4 4 6 9 4 4 3 3 4 3 2 3 4 4 2 9 10 8 8 9 8 9 10 29 9 5 4 5 12 0 25 7 3 3 6 14 8 6 3 4 8 3 2 8 35 31 37 30 6 10 7 2 18 24 8 1 5 19 4 2 2 4 3 2 2 3 3 2 2 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 3 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 3 3 4 3 2 3 3 2 3 3 3 3 3 4 6 6 13 12 31 36 44 9 11 7 4 4 3 3 4 3 3 3 3 3 3 3 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 2 2 2 2 3 2 2 2 3; 1HNMR: 87 87 d 1H J 19 \| 83 82 d 1H J 15 \| 79 79 dd 1H J 19 82 \| 78 78 dd 1H J 15 86 \| 77 76 d 1H J 86 \| 74 73 dd 1H J 14 73 \| 73 72 d 1H J 81 \| 72 71 td 1H J 13 75 \| 71 70 td 1H J 14 80 \| 69 69 dd 1H J 13 82 \| 39 39 s 3H \| 35 35 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C#CCN1CCC(C(=O)OC)CC1	ir: 69 43 13 10 25 67 28 37 23 16 20 19 5 48 20 5 3 4 4 1 2 3 3 2 2 2 5 23 2 4 4 2 10 4 4 2 2 3 2 1 13 3 2 1 2 3 2 1 2 4 6 2 6 6 6 3 19 28 15 37 16 10 7 21 20 6 10 22 19 14 5 10 28 8 46 70 43 40 14 14 12 19 91 5 42 77 14 6 5 4 3 3 4 3 5 5 7 14 18 41 10 19 16 10 30 44 26 12 8 11 23 76 80 31 14 12 17 7 20 21 53 13 5 18 12 9 6 11 7 14 33 17 5 4 4 6 6 4 4 7 8 4 13 19 100 55 23 15 3 2 2 3 3 1 1 3 2 0 1 3 2 0 1 3 2 0 1 3 2 0 2 3 1 0 2 3 12 9 2 4 1 0 2 3 1 0 2 3 1 0 2 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 0 1 3 2 0 1 3 2 0 1 3 2 0 1 3 2 0 1 3 2 0 1 3 1 0 2 3 1 0 2 3 1 0 2 3 1 0 2 3 1 0 2 2 1 1 2 2 1 1 2 2 1 1 3 3 1 1 3 3 1 2 5 5 3 3 5 24 10 13 14 6 6 7 12 27 6 64 28 8 2 2 3 2 1 2 3 2 1 2 2 1 1 2 2 2 31 16 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 0 1 3 2 0 1 3 1 0 1 3 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2; 1HNMR: 37 37 d 2H J 25 \| 37 36 s 2H \| 30 29 ddd 2H J 46 73 118 \| 27 27 ddd 2H J 46 73 118 \| 26 25 t 1H J 25 \| 26 25 p 1H J 58 \| 22 21 dddd 2H J 46 58 73 130 \| 19 18 dddd 2H J 46 58 72 126	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)CCN(Cc1cccc(C#N)c1)C(=O)OC(C)(C)C	ir: 4 11 12 4 3 6 10 7 5 9 10 26 11 5 2 2 2 2 1 2 3 2 1 2 5 3 1 1 1 1 1 4 6 8 3 29 9 3 6 4 1 1 1 4 3 2 3 6 9 2 4 3 2 1 1 2 1 1 1 2 2 5 5 3 1 1 2 2 2 6 2 2 1 0 1 1 1 1 2 2 1 2 2 1 1 3 4 3 4 2 2 2 2 2 2 2 2 2 6 4 3 3 1 2 3 3 7 2 3 1 3 3 3 6 6 6 2 6 3 19 8 13 14 13 28 16 10 19 6 15 23 15 12 9 12 6 4 2 1 3 15 9 2 11 26 14 2 2 2 1 9 100 6 4 6 1 1 1 1 1 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 3 4 2 3 4 4 3 3 2 4 2 4 4 5 24 21 11 68 9 5 2 4 1 1 1 2 1 1 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0; 1HNMR: 78 77 td 1H J 10 21 \| 77 77 ddd 1H J 11 22 66 \| 75 74 dd 1H J 65 72 \| 74 73 ddq 1H J 10 22 73 \| 44 43 d 2H J 9 \| 35 35 t 2H J 62 \| 27 26 t 2H J 62 \| 15 14 s 8H \| 14 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CS(=O)(=O)c1ccc(Oc2ccc(N)cc2)cn1	ir: 12 18 33 10 4 8 4 9 2 6 22 9 5 4 3 2 3 2 4 2 2 4 4 2 1 3 3 3 4 5 3 2 1 4 6 6 5 3 9 1 2 3 2 1 2 3 4 0 1 4 3 0 6 30 16 41 28 11 3 4 2 3 2 1 2 3 11 4 5 13 5 1 2 3 2 1 5 5 11 6 5 5 9 18 22 43 9 8 11 6 8 3 2 2 1 1 2 2 1 2 3 2 2 2 14 23 28 2 4 3 2 6 6 2 0 2 3 2 4 9 7 7 2 3 3 2 1 2 2 1 1 2 4 9 1 2 2 1 1 2 2 1 1 2 2 1 2 3 11 4 3 5 10 12 24 78 60 33 10 7 6 1 11 38 6 1 2 3 2 0 1 3 2 0 1 3 1 0 2 2 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 3 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 4 3 1 1 2 2 1 5 3 4 1 2 4 9 17 9 6 11 34 11 6 5 2 2 2 2 1 2 3 1 1 2 2 2 2 4 53 34 17 4 3 0 0 2 3 0 1 20 52 100 28 16 5 2 2 2 2 2 2 2 2 1 1 2 1 1 1 2 2 1 2 2 2 1 1 2 1 1 1 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2; 1HNMR: 82 82 d 1H J 19 \| 80 80 d 1H J 90 \| 73 73 dd 1H J 19 91 \| 68 68 m 2H \| 67 67 m 2H \| 42 42 s 2H \| 34 33 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCN(C(=O)Nc1ccccc1)S(=O)(=O)c1cccc(C)c1C#N	ir: 7 4 3 6 12 6 5 9 22 8 8 12 8 14 18 6 7 4 6 7 9 5 2 10 24 46 20 7 7 8 10 8 5 5 5 6 9 6 12 24 18 36 100 39 55 10 12 27 7 3 5 8 4 0 3 6 4 12 5 6 4 2 9 12 17 13 21 53 4 17 8 9 3 3 8 8 4 3 6 8 5 2 7 8 78 8 7 9 6 22 6 10 29 4 4 4 2 3 13 5 2 3 5 8 29 7 6 4 4 11 6 4 2 5 6 3 4 5 7 4 2 3 7 3 1 4 8 5 3 4 5 7 18 7 15 10 4 4 4 9 13 9 6 4 6 5 19 71 15 9 8 88 28 25 12 5 8 14 4 0 10 11 3 2 4 6 3 0 3 5 3 0 3 5 3 0 3 5 2 0 3 6 16 2 3 5 2 1 3 4 2 2 4 4 2 1 4 4 2 2 4 4 1 2 4 4 1 2 4 4 1 2 4 3 1 2 4 3 1 2 5 3 1 2 5 3 1 3 5 3 1 3 5 3 1 3 5 3 1 3 5 2 1 3 5 2 1 4 4 2 1 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 5 4 1 3 5 4 2 3 6 4 2 4 6 4 2 5 15 17 6 27 63 35 12 9 5 4 6 4 5 4 3 4 5 3 2 4 5 4 3 4 11 9 12 7 6 45 51 20 9 2 3 5 4 1 2 4 3 2 2 4 3 1 2 4 3 1 3 4 3 1 3 5 3 1 3 5 3 1 3 4 2 1 3 4 2 1 3 4 2 1 3 4 2 2 3 4 2 2 3 4 2 2 3 3 2 2 4 3 2 2 4 3 2 2 4 3 1 2 4 3 2 2 4 3 1 2 4 3 1 3 4 3 1; 1HNMR: 83 83 s 1H \| 78 78 dd 1H J 11 86 \| 76 75 dd 1H J 76 85 \| 75 74 m 2H \| 73 72 m 3H \| 70 70 tt 1H J 11 68 \| 37 36 q 2H J 85 \| 24 24 d 3H J 7 \| 14 13 t 3H J 85	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(O)c1cccnc1CN1CCC(c2cn(Cc3cccnc3)c3ccccc23)CC1	ir: 4 4 5 8 8 4 6 5 5 7 6 3 7 7 12 10 11 13 33 32 40 42 70 73 17 16 9 15 9 7 9 24 43 17 28 17 9 27 9 15 15 20 17 41 14 6 8 6 3 3 4 3 5 4 7 6 9 3 8 6 7 11 40 9 12 17 7 3 5 28 10 8 8 9 16 30 30 18 34 100 17 28 23 17 8 10 15 12 3 9 11 31 9 4 5 3 4 7 2 7 8 6 10 7 2 3 3 2 2 4 0 6 19 4 5 8 12 5 3 7 7 16 20 7 5 3 7 12 6 9 6 4 5 5 9 10 5 19 32 44 16 7 5 21 21 11 7 13 10 5 13 33 7 4 30 60 4 6 10 25 2 3 2 1 1 2 1 1 1 2 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 2 4 4 5 3 3 2 3 2 3 7 12 22 26 24 65 25 34 3 4 7 2 1 35 48 17 8 2 1 2 2 1 0 1 2 0 1 1 2 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 86 86 dd 1H J 20 44 \| 85 84 dd 2H J 21 39 \| 81 80 dd 1H J 20 81 \| 78 77 m 1H \| 77 76 dddd 1H J 8 19 28 68 \| 75 75 dd 1H J 14 64 \| 73 73 ddd 1H J 13 66 75 \| 73 71 m 3H \| 70 70 m 1H \| 55 55 q 2H J 8 \| 41 40 s 2H \| 31 30 m 1H \| 29 28 ddd 2H J 52 80 121 \| 27 26 ddd 2H J 52 80 119 \| 22 21 ddt 2H J 52 81 128 \| 19 18 ddt 2H J 51 79 125	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=CC(=O)N(CCN)C(CC)c1nc2cc(Cl)ccc2c(=O)n1Cc1ccccc1	ir: 2 2 2 2 3 3 3 2 2 2 3 2 2 2 2 2 2 2 2 2 3 2 2 3 2 2 2 2 2 3 4 2 4 5 3 2 2 4 5 8 6 3 3 3 4 5 4 6 7 8 6 5 3 2 3 4 3 3 3 3 4 4 5 3 5 11 3 4 7 3 3 6 4 18 13 7 3 4 4 2 2 2 5 6 2 2 2 2 5 9 4 3 2 3 3 3 2 2 4 3 2 2 3 2 3 2 2 2 2 2 2 2 2 2 4 3 4 4 6 4 3 4 5 5 4 3 3 2 4 6 3 3 8 8 7 8 3 4 3 3 4 5 5 12 5 4 4 4 7 4 2 3 3 5 2 5 3 52 18 0 2 3 4 1 2 3 2 1 2 3 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 3 2 3 4 3 3 3 3 6 6 35 13 5 3 3 3 3 3 4 3 3 3 3 4 3 5 7 7 4 3 2 5 100 20 5 2 1 3 3 2 2 3 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2; 1HNMR: 83 82 d 1H J 85 \| 77 76 d 1H J 20 \| 75 74 dd 1H J 20 86 \| 73 72 m 3H \| 72 72 ddt 2H J 8 16 78 \| 63 62 m 1H \| 59 58 dd 1H J 24 167 \| 58 57 dd 1H J 24 114 \| 52 51 m 2H \| 42 42 tq 1H J 15 62 \| 35 34 dt 1H J 51 135 \| 34 33 dt 1H J 50 134 \| 30 29 m 1H \| 30 29 m 1H \| 29 28 td 2H J 15 66 \| 21 20 dqd 1H J 61 77 112 \| 19 18 dqd 1H J 60 77 112 \| 10 9 td 3H J 15 77	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1ccc2c(c1)OC(F)(F)O2	ir: 2 8 100 11 7 3 2 1 6 1 1 1 1 1 1 1 1 2 1 5 1 1 3 1 1 1 1 1 1 1 3 6 1 1 1 1 1 2 1 1 1 1 1 1 3 2 1 3 2 1 1 0 1 2 11 5 2 1 1 1 1 1 1 1 1 2 4 1 3 2 1 0 1 2 3 3 2 2 1 1 1 1 2 1 1 2 2 1 3 3 1 1 1 1 1 7 3 4 26 62 4 3 0 1 3 2 1 4 12 15 2 3 3 3 1 1 3 4 5 4 2 1 6 2 1 1 1 2 2 1 1 3 1 1 1 4 1 1 1 4 2 1 8 1 1 0 1 3 1 1 3 3 17 2 41 5 2 1 43 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 1 1 3 2 3 4 3 2 16 6 2 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 2 3 3 3 1 6 18 31 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 84 84 s 1H \| 71 71 d 1H J 77 \| 70 70 dd 1H J 7 19 \| 69 69 ddd 1H J 7 20 77 \| 49 49 m 1H \| 37 37 s 5H \| 22 22 t 7H J 12	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)C1CCC(C(F)(F)F)NC1	ir: 2 1 2 3 3 11 10 4 2 3 2 6 6 5 1 1 1 1 0 1 1 1 0 1 4 4 2 0 1 1 2 1 1 1 1 2 5 4 2 1 2 4 24 12 7 0 1 3 1 2 4 6 2 4 5 8 16 6 8 1 3 2 7 5 2 7 4 2 5 5 2 2 3 2 1 2 1 1 1 1 1 0 1 1 0 0 1 1 5 4 2 1 1 3 1 2 3 3 12 7 1 1 5 5 5 4 3 2 3 2 5 13 17 19 16 100 75 9 5 5 3 3 2 2 2 3 4 6 6 7 5 2 1 4 8 8 4 1 1 1 1 2 3 9 8 5 2 2 2 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 2 4 2 1 1 3 3 4 3 6 13 5 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 3 12 22 52 24 3 1 2 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0; 1HNMR: 37 36 m 2H \| 36 36 s 2H \| 33 32 dt 1H J 37 126 \| 31 30 dt 1H J 37 125 \| 26 25 tt 1H J 37 53 \| 21 20 m 1H \| 19 17 m 2H \| 16 15 ddtt 1H J 23 46 70 128	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(c1ccc(/C=C\c2ccc(Cl)cc2)cc1)N1CCc2ccoc2C1	ir: 2 10 27 14 7 7 13 6 14 13 18 15 3 8 11 3 1 8 10 4 1 10 14 5 5 9 10 6 4 10 14 4 14 32 12 12 11 19 28 29 17 14 17 5 5 11 7 0 9 14 9 6 100 23 13 5 20 17 29 30 15 10 8 2 6 9 5 1 10 43 4 1 6 8 5 5 8 9 5 8 24 19 17 13 8 11 6 6 12 9 5 31 22 10 14 11 17 12 7 6 25 20 3 6 12 14 12 11 14 6 0 5 13 7 2 8 11 10 5 8 17 18 9 23 24 43 44 74 10 7 3 9 10 4 4 8 9 6 4 8 9 7 10 51 23 18 19 17 31 17 20 22 37 11 8 9 14 5 4 8 6 3 6 8 19 0 4 9 5 0 5 9 5 0 5 9 4 1 5 8 4 1 5 8 4 1 6 8 3 2 6 7 3 2 6 7 3 3 7 7 3 3 7 7 2 3 7 6 2 3 7 6 2 3 7 5 1 4 8 5 1 4 8 5 1 4 8 5 1 5 8 4 1 5 8 4 1 5 8 4 2 5 7 3 2 6 7 3 2 6 7 3 2 6 6 3 3 7 6 3 3 7 7 2 3 8 6 2 4 8 5 2 4 9 7 6 8 8 7 4 9 11 11 12 40 82 58 99 78 33 25 21 10 12 12 7 8 10 5 3 6 7 4 2 6 7 4 3 6 7 3 3 6 6 3 3 6 6 3 3 6 6 2 3 7 5 2 4 7 5 2 4 7 5 2 4 7 5 1 4 7 4 1 4 7 4 1 5 7 4 2 5 7 4 2 5 7 4 2 5 6 3 2 6 6 3 3 6 6 3 3 6 6 3 3 6 6 3 3 6 5 2 4 7 5 2 4 7 5 2 4 7 5 2 4 7 5 2 4 7; 1HNMR: 79 78 m 2H \| 76 76 m 2H \| 75 74 m 2H \| 74 73 m 3H \| 68 67 s 2H \| 62 62 dt 1H J 9 18 \| 45 45 s 2H \| 39 38 m 2H \| 29 29 tdd 2H J 8 15 45	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccc(CN2CC3CCC2C3Nc2ccc3[nH]ncc3c2)cc1OCCO	ir: 14 12 10 4 8 16 16 19 10 13 11 17 7 7 5 4 4 1 3 3 6 4 1 2 3 13 7 6 3 3 86 7 4 4 3 1 1 9 2 5 48 13 3 2 1 3 4 3 6 4 2 10 6 25 21 10 2 3 2 3 2 5 2 5 4 2 6 22 9 14 5 3 4 2 3 2 1 2 5 38 6 4 3 5 12 49 24 18 13 9 10 8 31 7 4 10 14 4 3 6 5 5 73 7 8 4 3 5 4 4 18 48 43 11 11 13 2 3 3 4 2 3 4 5 5 8 4 1 3 3 3 16 9 12 5 4 3 2 1 1 1 2 10 5 5 1 0 3 12 41 36 4 6 6 12 12 12 18 11 4 2 1 1 1 3 4 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 1 0 0 0 1 1 1 0 0 1 1 1 1 2 3 4 2 2 4 4 3 3 5 17 6 42 43 14 10 6 2 4 8 16 96 19 3 1 3 2 1 1 0 2 2 2 5 6 4 13 40 100 30 59 17 32 3 3 2 1 1 0 1 2 1 0 1 0 1 0 1 1 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 83 82 d 1H J 15 \| 75 74 dt 1H J 10 79 \| 71 71 dq 1H J 10 81 \| 70 69 ddt 1H J 9 18 82 \| 68 68 m 2H \| 67 67 dt 1H J 8 17 \| 51 51 d 1H J 55 \| 41 41 t 2H J 47 \| 38 38 dt 1H J 8 121 \| 38 37 m 3H \| 36 35 dt 1H J 9 123 \| 34 34 t 1H J 62 \| 32 32 q 1H J 24 \| 32 31 dd 1H J 16 116 \| 28 27 dd 1H J 15 115 \| 25 24 qt 1H J 15 31 \| 22 21 d 3H J 11 \| 20 18 m 2H \| 17 16 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N=C(N)NCCCCC=CC(=O)NC(O)C(=O)NCCCCNCCCN	ir: 14 18 4 11 21 16 11 14 11 17 30 30 8 45 29 21 6 10 7 5 2 4 8 5 3 15 6 3 3 7 7 3 1 5 9 3 8 16 32 48 51 51 37 38 20 7 17 8 31 12 16 15 13 10 16 7 5 2 3 7 3 3 4 8 4 2 3 1 10 8 19 15 21 38 14 11 10 8 16 3 9 13 13 13 9 11 1 3 33 89 46 31 6 8 6 3 3 5 4 5 6 6 3 3 5 1 6 6 3 11 34 35 19 15 18 25 15 13 8 10 11 24 16 15 12 4 5 4 7 7 11 30 23 32 18 15 14 4 8 8 14 58 46 26 14 24 12 15 25 23 6 3 2 3 2 1 1 1 1 1 2 2 4 8 5 8 37 100 53 100 94 49 54 10 4 6 2 1 1 1 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 0 1 0 1 0 1 1 1 1 2 4 3 2 1 1 1 1 1 1 1 0 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 2 1 5 3 3 4 2 2 3 3 4 3 3 3 29 7 9 6 3 15 14 34 24 37 61 21 55 37 19 22 26 36 44 27 35 32 86 50 70 98 69 53 53 30 25 6 3 2 1 3 1 1 0 2 2 2 2 2 3 2 1 1 1 0 1 1 1 0 1 1 1 1 1 2 1 0 1 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 85 84 d 1H J 78 \| 70 69 m 2H \| 68 67 dtt 1H J 8 56 148 \| 63 63 s 2H \| 61 60 dt 1H J 12 148 \| 54 54 t 1H J 34 \| 53 53 d 1H J 40 \| 52 52 dd 1H J 40 81 \| 33 32 td 2H J 33 45 \| 32 31 m 2H \| 28 27 m 4H \| 27 26 q 2H J 50 \| 23 22 m 2H \| 17 16 p 1H J 49 \| 17 16 p 2H J 51 \| 16 15 m 2H \| 16 15 m 1H \| 15 14 m 6H \| 13 12 t 2H J 62	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CNS(=O)(=O)c1ccc(-n2cccc2-c2ccc(F)cc2)cc1	ir: 2 11 2 4 4 1 2 1 1 1 1 2 1 3 5 7 8 1 2 2 3 6 2 1 1 1 1 1 1 1 1 1 1 3 1 2 2 3 4 2 9 8 5 4 34 34 13 6 9 3 15 13 31 37 45 100 18 13 7 3 2 4 2 19 3 4 6 3 4 3 4 5 2 3 1 3 2 12 11 6 7 3 4 49 87 17 8 4 9 2 2 4 4 2 2 1 4 3 7 4 7 2 7 4 18 37 57 64 26 9 4 3 4 2 2 2 1 1 8 4 1 1 1 5 12 7 3 1 7 6 1 1 1 1 1 7 1 1 0 1 2 1 20 9 3 3 12 5 2 10 2 8 10 2 2 0 1 1 1 0 1 1 8 2 1 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 1 0 0 0 0 0 0 0 1 1 0 0 1 0 0 1 1 1 0 1 2 1 2 7 10 38 82 23 34 22 16 7 2 2 2 2 2 1 1 1 1 1 2 2 1 2 6 21 29 6 2 0 1 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 79 78 m 2H \| 77 76 m 2H \| 76 75 m 2H \| 74 73 dd 1H J 17 47 \| 71 71 m 2H \| 69 68 dd 1H J 16 64 \| 66 65 dd 1H J 46 64 \| 53 53 q 1H J 67 \| 27 27 d 3H J 66	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC1=C[C@@H]2[C@H](C1)C[C@]2(CN)CC(=O)O	ir: 3 5 3 3 3 4 8 3 4 3 6 5 6 8 7 4 3 4 6 6 21 63 33 7 5 5 5 3 3 3 3 3 3 3 2 3 3 3 3 3 3 3 3 3 3 3 4 6 10 13 5 5 4 3 4 3 5 31 8 5 4 4 3 3 3 3 4 5 8 4 5 4 8 10 12 35 9 32 22 18 12 7 5 9 4 8 7 13 3 3 3 8 4 2 3 4 4 5 4 10 3 4 5 5 3 3 3 3 4 4 4 3 2 3 3 3 3 4 4 3 6 5 9 8 4 8 5 8 5 10 6 10 12 15 9 7 6 4 3 3 5 3 3 11 38 8 4 3 4 3 3 2 2 4 3 2 2 3 2 2 2 3 2 2 2 3 3 2 2 3 2 2 2 3 3 2 3 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 3 3 3 2 2 3 3 2 2 3 3 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 3 5 3 3 2 3 3 2 2 2 3 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 3 2 2 3 3 3 3 3 3 3 3 3 3 3 4 3 4 5 5 4 7 5 6 8 3 3 3 2 3 4 2 0 100 92 16 11 7 11 18 13 4 4 3 4 2 41 5 4 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 4 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2; 1HNMR: 54 53 m 1H \| 31 30 dtd 1H J 9 52 115 \| 29 28 m 1H \| 26 26 d 1H J 174 \| 24 24 t 2H J 53 \| 24 23 d 1H J 176 \| 22 21 m 2H \| 20 19 m 1H \| 18 17 dd 1H J 64 126 \| 18 17 m 1H \| 17 16 t 3H J 13 \| 16 15 ddd 1H J 9 62 126	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(C(=O)OC(C)(C)C)[C@H]1CCN(S(=O)(=O)c2cccc3cncc(F)c23)C1	ir: 11 19 8 20 5 8 28 14 17 34 25 38 29 51 100 48 21 21 11 14 11 17 12 5 3 5 5 6 5 4 4 1 2 4 3 2 2 4 5 2 6 15 5 7 11 29 32 6 6 7 6 2 4 4 3 5 3 7 6 1 6 9 14 17 5 4 9 76 23 21 12 30 57 27 7 8 15 32 43 10 55 78 51 14 20 34 60 30 25 20 19 47 16 13 13 4 7 10 5 4 3 7 7 24 40 15 3 4 12 7 5 16 27 14 1 14 23 10 7 28 14 8 11 45 23 23 7 13 20 13 3 18 6 5 5 9 11 17 11 12 13 3 1 6 6 0 11 39 14 7 13 14 5 10 5 1 8 5 4 6 8 4 2 2 3 17 3 4 3 2 2 3 2 2 2 3 2 2 2 3 2 1 2 3 2 1 2 3 2 1 3 3 2 1 3 3 2 2 3 3 2 2 3 3 1 2 3 3 1 2 3 3 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 4 2 1 2 3 2 1 3 3 2 1 3 3 2 1 3 3 2 1 3 3 2 1 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 3 5 6 4 4 5 4 3 5 5 5 5 12 7 10 26 40 27 10 72 17 10 3 3 3 4 2 1 3 4 2 1 3 3 2 1 3 3 2 1 3 3 2 2 3 3 1 1 3 3 1 1 3 3 1 2 3 3 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 3 3 2 1 3 3 2 1 3 3 2 1 3 3 1 2 3 3 1 2 3 3 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3; 1HNMR: 90 89 t 1H J 19 \| 83 82 dd 1H J 16 141 \| 80 80 ddd 1H J 12 20 84 \| 80 79 dd 1H J 12 88 \| 77 76 t 1H J 86 \| 44 44 dtp 1H J 17 36 71 \| 35 34 m 2H \| 34 33 dddd 1H J 17 58 76 126 \| 33 32 m 1H \| 28 28 d 3H J 16 \| 23 22 dddd 1H J 39 59 74 112 \| 21 20 ddt 1H J 58 77 112 \| 15 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1cccc2c1CN(C)CC2	ir: 21 11 19 6 8 13 5 3 5 3 5 4 4 2 0 3 4 3 3 2 2 1 1 2 2 1 1 4 6 10 3 3 6 2 6 8 5 1 1 2 2 1 1 3 6 8 18 10 7 3 5 4 2 0 2 3 2 1 2 3 2 0 2 3 2 3 3 3 2 1 2 2 1 1 2 6 4 1 2 3 6 10 7 5 1 1 17 8 29 3 10 21 15 15 10 3 2 11 5 12 2 4 6 7 5 3 2 2 1 1 2 1 1 2 3 6 4 6 4 12 3 6 6 4 3 3 3 2 1 3 3 2 1 2 2 3 6 10 4 2 3 12 7 9 11 100 42 3 4 5 8 1 1 2 2 1 1 3 2 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 3 4 2 2 3 2 2 4 13 3 6 9 16 6 2 2 2 1 1 2 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0; 1HNMR: 78 78 dd 1H J 12 81 \| 72 71 m 1H \| 71 70 dq 1H J 9 79 \| 39 39 d 5H J 33 \| 30 29 m 2H \| 29 28 ddd 2H J 9 42 54 \| 24 24 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C[C@H]1CC(=O)[C@]2(CO2)C12CCCCCC2	ir: 1 2 2 3 4 1 2 2 2 1 1 1 2 4 1 1 1 3 2 1 1 1 4 2 1 1 1 2 2 2 1 1 1 1 1 1 1 2 2 1 2 1 1 1 1 6 4 3 2 1 3 2 2 1 1 1 1 1 1 1 2 1 1 1 2 1 1 2 2 2 1 1 2 4 0 22 4 1 1 1 1 2 1 7 2 1 2 4 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1 2 1 1 2 3 6 3 3 5 5 5 1 2 3 2 3 4 3 3 3 4 3 2 2 11 4 3 1 1 1 1 1 1 1 2 1 2 1 0 1 7 100 7 3 0 0 1 1 0 0 1 1 0 1 1 1 2 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 1 1 1 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 2 2 4 5 3 2 3 2 5 4 1 10 6 2 1 1 1 3 5 2 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 37 37 d 1H J 40 \| 34 34 d 1H J 40 \| 27 26 dd 1H J 57 159 \| 24 23 dd 1H J 77 159 \| 20 19 m 1H \| 17 16 m 2H \| 15 12 m 11H \| 10 10 d 3H J 70	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COCOCC(CO)c1ccc(Cl)cc1	ir: 25 19 50 20 26 25 36 32 0 23 15 18 18 36 78 12 7 6 8 9 8 4 7 4 4 5 5 3 4 5 4 4 5 5 5 10 4 5 5 3 4 5 4 3 4 8 10 9 12 16 12 6 9 21 42 76 15 16 5 3 4 6 12 9 21 29 14 32 38 20 43 32 64 52 8 12 12 16 9 6 4 4 5 8 10 15 9 13 9 59 100 75 15 11 32 77 16 8 6 8 7 6 7 4 5 8 7 14 8 6 4 5 6 5 4 4 6 6 4 5 5 4 5 7 13 8 5 6 5 7 5 4 5 3 3 3 4 3 3 3 4 3 4 5 5 5 55 74 16 9 6 6 6 8 3 4 4 4 3 3 5 4 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 4 3 3 3 3 4 3 3 3 3 3 3 3 3 3 3 3 4 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 4 3 3 4 4 3 3 4 6 6 4 4 5 8 8 6 13 10 10 29 75 79 29 12 14 11 48 45 56 9 5 4 4 4 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3; 1HNMR: 73 72 m 2H \| 72 71 m 2H \| 44 44 m 2H \| 40 40 ddd 2H J 19 59 119 \| 38 37 ddd 2H J 35 60 119 \| 33 33 s 2H \| 33 32 t 1H J 56 \| 32 31 m 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)C(=CN(C)C)C(=O)c1cc(Br)c(OC)cc1OC	ir: 12 6 4 12 8 10 4 6 9 4 2 11 13 5 3 7 9 5 5 7 10 5 9 9 11 14 5 12 12 16 7 13 9 2 5 10 18 3 8 13 9 3 8 52 30 7 9 9 6 1 5 9 6 0 5 15 5 3 5 10 6 3 13 33 23 18 31 64 35 10 8 12 19 4 22 13 6 5 12 9 4 3 7 11 8 5 7 8 5 6 14 18 8 6 11 7 4 5 12 11 4 6 14 7 1 6 10 21 10 12 19 6 1 8 16 7 6 17 20 19 9 7 9 12 12 8 33 14 25 13 8 6 4 6 6 5 7 44 17 6 6 35 13 6 4 11 38 7 11 13 56 100 13 41 12 2 3 8 6 1 5 14 10 32 7 9 5 0 4 9 4 0 4 8 4 0 5 8 4 1 5 7 3 1 5 7 3 1 5 7 3 1 5 6 3 2 6 6 2 2 6 6 2 3 6 6 2 3 6 5 2 3 7 5 1 3 7 5 1 4 7 4 1 4 7 4 1 4 8 4 1 4 7 4 1 5 7 4 1 5 7 3 2 5 7 3 2 5 6 3 2 5 6 3 2 6 6 2 3 6 6 3 3 6 5 2 3 7 6 3 5 7 6 2 4 7 6 3 6 8 7 4 5 16 16 10 25 52 23 5 6 8 4 2 5 7 3 2 5 6 3 2 5 6 3 2 5 6 3 2 6 6 3 3 6 6 2 3 6 5 2 3 6 5 2 3 6 5 2 3 6 5 2 4 7 4 1 4 7 4 1 4 7 4 1 4 7 4 1 4 6 4 2 5 6 3 2 5 6 3 2 5 6 3 2 5 6 3 3 5 5 3 3 5 5 2 3 6 5 2 3 6 5 2 3 6 5 2 4 6 4 2 4 6 4 2 4 7 4 1; 1HNMR: 83 82 p 1H J 10 \| 82 81 s 1H \| 67 67 s 1H \| 43 43 q 2H J 71 \| 39 39 s 3H \| 39 38 s 3H \| 27 27 d 5H J 9 \| 13 12 t 3H J 71	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(C(=O)OC(C)(C)C)c1cnc2ccc(=O)n(CC3OCCO3)c2c1	ir: 3 19 39 18 17 16 9 4 2 19 24 17 31 27 19 11 4 7 9 8 7 10 18 18 7 5 6 2 2 5 5 1 7 8 4 2 3 5 5 2 5 13 24 8 18 18 31 65 25 9 5 3 5 6 5 4 6 9 6 2 7 12 7 5 7 17 11 9 11 14 11 15 62 18 31 15 20 6 14 9 7 9 4 13 7 5 3 5 8 6 2 2 6 6 6 73 20 7 5 6 7 5 6 3 6 5 2 5 9 6 11 6 7 5 9 23 11 6 3 30 26 10 12 9 10 6 3 17 25 21 70 21 15 7 6 7 6 5 5 19 4 3 4 5 5 10 67 55 56 36 100 30 46 1 2 27 7 0 3 8 29 0 5 5 12 2 4 5 3 0 3 6 3 0 3 5 3 1 3 5 2 1 3 5 3 1 3 6 3 1 4 5 2 1 4 4 2 1 4 4 2 2 4 4 1 2 4 4 1 2 4 3 1 2 5 3 1 2 5 3 1 2 5 3 1 3 5 3 1 3 5 3 1 3 5 3 1 3 5 2 1 3 4 2 1 3 4 2 1 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 5 4 2 3 6 5 4 4 6 5 5 4 5 4 4 5 7 5 11 28 22 14 12 29 46 53 6 6 6 5 2 4 5 3 2 4 4 2 1 4 4 2 1 4 4 2 1 4 4 2 2 4 4 2 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 2 5 3 1 3 5 3 1 3 5 3 1 3 4 2 1 3 4 2 1 3 4 2 1 3 4 2 2 3 4 2 2 4 4 2 2 4 4 2 2 4 3 2 2 4 3 2 2 4 3 1 2 4 3 1 2 4 3 1 3 4 3 1 3 4; 1HNMR: 83 82 d 1H J 16 \| 79 79 d 1H J 92 \| 77 76 d 1H J 18 \| 68 67 d 1H J 93 \| 53 52 t 1H J 21 \| 44 43 d 2H J 20 \| 40 39 m 2H \| 39 38 m 2H \| 31 31 s 3H \| 14 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(c1ccc(Cl)cc1)c1ccc(-n2ncc(=O)[nH]c2=O)cc1Cl	ir: 0 1 2 1 1 2 3 2 4 1 1 1 1 2 6 3 5 3 3 13 3 1 1 1 1 1 1 5 7 6 2 1 1 1 1 2 4 6 6 15 2 3 1 1 1 1 1 0 1 4 3 1 1 3 12 15 63 9 4 10 2 1 0 1 1 3 9 11 6 11 1 1 0 0 0 0 0 0 0 0 0 1 0 0 1 1 1 2 1 2 2 5 8 3 2 1 0 0 1 1 1 1 1 1 1 4 3 1 6 3 1 0 0 1 1 2 2 4 13 3 1 1 1 2 12 9 3 6 5 2 1 1 1 2 9 16 4 4 7 9 7 100 7 1 3 4 2 7 5 10 11 3 5 4 6 12 28 8 2 0 0 5 9 4 12 34 3 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 1 0 1 1 1 1 1 2 1 12 12 50 7 4 2 1 2 3 1 0 1 1 1 1 3 4 2 1 1 1 1 1 1 2 3 6 18 9 4 2 6 2 1 0 0 0 1 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 95 95 s 1H \| 79 79 d 1H J 22 \| 78 77 m 2H \| 77 77 d 1H J 76 \| 77 76 dd 1H J 22 75 \| 76 76 m 2H \| 66 66 s 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N#C[C@@H]1CCCN1C(=O)c1nc2c(s1)CCOc1cc(-c3cn[nH]c3)ccc1-2	ir: 1 1 2 1 1 1 2 2 2 3 6 11 9 3 4 1 2 2 2 0 0 3 2 1 0 2 2 4 1 2 2 0 1 2 2 2 3 10 6 11 5 4 2 1 18 5 35 100 7 33 2 2 2 2 10 4 3 3 1 1 3 2 1 4 2 3 5 1 3 9 4 1 2 2 2 1 2 41 3 1 1 6 1 0 4 2 1 1 2 6 9 6 3 5 2 1 3 1 4 3 1 1 1 2 2 2 1 2 1 5 4 13 8 6 8 15 9 6 6 3 5 3 1 1 3 2 1 2 2 2 2 1 2 6 4 44 3 1 1 2 1 0 2 11 3 1 1 3 7 22 4 3 1 4 10 1 3 0 1 1 1 0 1 1 1 2 1 1 1 0 1 1 1 0 1 1 1 0 1 3 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 1 1 1 0 1 1 1 0 1 2 2 3 3 3 2 1 3 3 3 6 4 3 7 4 12 2 6 4 4 2 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 2 3 7 2 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 83 83 d 1H J 16 \| 79 79 dd 1H J 17 34 \| 78 78 d 1H J 86 \| 75 74 dd 1H J 17 87 \| 73 73 d 1H J 17 \| 49 49 ddt 1H J 19 27 47 \| 44 44 t 2H J 62 \| 38 37 m 1H \| 37 36 m 1H \| 32 31 t 2H J 62 \| 22 21 m 1H \| 21 20 dddd 1H J 20 37 75 122 \| 20 19 ddqd 2H J 23 36 71 149	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)N(C(C)C)S(=O)c1nc2ccccc2s1	ir: 1 4 10 8 1 3 6 5 9 6 6 3 1 7 10 4 2 6 8 17 7 18 14 4 5 7 5 2 2 4 4 2 2 7 5 2 16 6 6 9 100 63 29 2 3 7 26 4 4 6 4 1 3 5 5 0 5 17 4 4 3 5 3 1 5 6 24 14 7 9 8 8 5 8 15 6 7 9 5 7 19 34 38 11 18 77 14 13 5 4 4 3 5 4 3 6 5 18 54 15 10 9 12 16 11 6 12 22 8 5 0 3 7 4 1 4 7 5 2 9 8 19 10 8 9 2 3 5 10 14 29 14 27 28 3 7 33 22 8 4 17 5 4 4 4 3 3 6 6 3 2 4 4 2 3 4 3 1 5 5 3 2 3 5 3 1 2 5 3 1 3 5 3 1 3 4 3 1 3 4 3 1 3 4 2 1 3 4 2 1 3 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 3 4 3 1 3 5 3 1 3 4 2 1 3 4 3 1 3 4 2 1 3 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 3 2 2 4 3 2 3 4 7 3 4 4 4 2 3 6 9 4 7 9 12 5 44 16 27 72 59 7 5 1 4 5 3 2 7 4 2 1 3 4 2 2 3 4 2 2 3 4 2 2 4 4 2 2 4 3 2 2 4 3 2 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 3 4 3 1 3 4 3 1 3 4 2 1 3 4 2 1 3 4 2 2 3 4 2 2 3 4 2 2 3 3 2 2 3 3 2 2 3 3 2 2 4 3 2 2 4 3 2 2 4 3 1 2 4 3 1 3 4 3 1 3 4; 1HNMR: 82 82 m 1H \| 80 80 m 1H \| 75 74 td 1H J 16 72 \| 74 74 td 1H J 15 75 \| 38 37 hept 2H J 66 \| 12 12 d 12H J 64	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)CCCC#CCN1C(=O)CC[C@@H]1COC(=O)NCCc1ccccc1	ir: 4 7 1 3 3 3 2 2 3 4 2 4 3 2 1 2 3 2 2 4 8 6 5 2 5 15 11 16 11 6 10 4 4 2 1 2 2 2 5 12 6 7 6 4 2 6 4 1 2 2 2 1 2 2 1 2 1 2 1 1 2 6 3 2 2 2 3 4 3 4 2 1 2 2 3 4 3 2 3 4 1 1 1 1 2 2 3 2 2 2 1 3 3 1 2 2 3 3 6 1 3 2 2 2 2 2 6 4 3 3 5 8 7 7 7 3 3 6 11 12 12 8 4 4 3 3 2 4 3 4 3 6 4 4 2 7 3 3 1 2 2 3 9 7 24 9 8 14 12 100 9 0 1 4 2 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5 3 4 3 4 4 2 2 2 2 2 7 9 6 25 19 11 4 2 1 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 2 3 11 5 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 73 73 m 2H \| 73 72 m 3H \| 51 50 t 1H J 55 \| 44 44 m 1H \| 44 43 dt 1H J 26 110 \| 42 41 m 2H \| 40 40 dt 1H J 25 110 \| 37 36 s 2H \| 34 33 q 2H J 54 \| 28 28 tt 2H J 9 53 \| 26 25 dddd 1H J 17 49 66 141 \| 25 24 m 3H \| 24 23 tt 2H J 25 64 \| 21 20 m 1H \| 19 18 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cc(C(=O)C=C(c2cc(Cl)cc(Cl)c2)C(F)(F)F)ccc1C(N)=O	ir: 2 5 3 2 4 3 0 2 2 4 5 2 4 8 6 8 12 16 12 8 4 4 4 4 3 4 5 6 5 7 8 28 26 28 8 6 14 8 17 6 8 5 3 14 3 0 0 0 1 0 1 3 1 0 2 1 4 2 1 2 1 1 1 2 3 6 32 4 5 8 4 6 5 2 4 9 5 4 5 4 1 1 2 1 6 3 2 3 5 7 10 6 1 1 2 2 22 5 3 7 9 5 1 0 0 0 0 1 1 1 1 2 23 7 3 5 8 11 4 2 2 4 43 9 9 4 1 3 4 5 3 1 1 1 1 14 11 7 3 1 2 9 21 11 2 8 2 1 1 3 2 0 5 2 4 4 16 100 43 8 3 1 3 2 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 0 1 2 1 2 10 14 14 16 62 62 14 5 1 2 2 1 0 0 1 1 0 0 0 0 1 5 3 1 0 1 1 0 0 1 1 1 2 4 22 19 5 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 80 80 d 1H J 87 \| 79 79 dd 1H J 22 86 \| 78 78 d 1H J 20 \| 76 76 d 2H J 22 \| 74 74 t 1H J 21 \| 72 72 q 1H J 20 \| 70 70 s 2H \| 24 24 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=c1oc(=O)n(Cc2ccccc2)c2ncccc12	ir: 4 4 1 3 10 7 6 4 5 13 3 3 4 2 1 11 4 2 1 3 3 1 1 5 3 1 2 4 3 2 3 5 19 4 7 3 4 19 95 7 15 4 3 5 3 3 3 4 3 1 2 4 2 0 1 3 2 0 2 3 2 5 12 6 2 1 2 4 3 3 2 3 2 1 2 3 2 7 6 6 3 3 6 3 1 1 4 11 6 15 3 4 1 1 3 2 2 3 8 4 7 3 4 3 4 3 3 2 0 2 3 2 0 2 3 2 1 5 7 3 1 6 5 5 11 14 5 2 1 3 5 3 55 4 8 7 3 4 4 3 5 21 5 29 6 5 7 2 2 4 16 3 19 5 5 7 100 12 22 9 3 3 2 1 2 3 2 1 2 3 2 0 2 3 2 1 2 3 1 1 2 3 1 1 2 2 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 3 2 0 1 3 2 1 2 3 2 0 2 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 3 3 2 2 3 2 2 3 7 5 8 11 34 17 8 10 4 2 0 3 3 2 1 3 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 3 2 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1; 1HNMR: 86 85 dd 1H J 21 47 \| 81 80 dd 1H J 21 81 \| 74 73 dd 1H J 47 81 \| 73 72 m 5H \| 54 53 d 0H J 16 \| 54 53 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(F)c(C(=O)N(CCO)Cc2c(C)cc(C)nc2OCc2ccccc2)c1Cl	ir: 3 6 6 5 4 6 2 2 4 4 3 1 3 6 7 10 7 4 1 4 3 5 4 2 5 4 3 5 4 5 19 4 7 6 2 7 13 10 21 18 18 11 5 3 14 18 7 19 4 3 2 2 3 9 62 6 3 1 3 2 4 2 8 10 4 6 4 11 6 10 9 17 16 5 2 8 2 2 2 2 0 1 2 2 3 4 22 9 13 13 21 10 15 5 4 4 4 4 2 2 2 5 2 1 3 6 18 7 1 5 1 1 1 1 2 2 1 12 8 9 2 5 10 10 3 5 10 13 2 4 3 7 13 5 6 24 6 5 5 2 2 15 11 57 15 7 10 27 13 20 3 8 9 2 2 2 1 2 22 15 1 1 1 0 1 0 0 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 2 1 2 2 1 6 2 1 1 1 2 5 7 13 9 10 38 100 21 19 4 4 4 7 10 66 7 0 1 2 1 0 1 1 1 0 1 1 1 1 2 1 0 0 1 1 0 1 0 1 0 0 1 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 72 m 7H \| 70 69 dd 1H J 47 87 \| 64 63 t 1H J 8 \| 53 53 t 2H J 9 \| 48 47 s 2H \| 42 41 t 1H J 63 \| 39 39 s 3H \| 38 38 m 2H \| 37 36 t 2H J 57 \| 24 24 s 3H \| 23 22 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C#CCc1ccc(C)cc1	ir: 1 6 3 9 11 8 6 1 4 13 7 2 3 1 0 1 1 2 3 7 1 1 1 1 0 0 0 1 0 0 0 1 0 0 0 0 0 7 6 6 1 0 0 1 1 1 2 5 3 8 12 17 36 27 10 7 4 7 1 1 1 1 1 0 1 3 5 3 4 3 3 2 3 7 7 18 53 27 21 20 8 2 0 1 1 1 3 6 2 0 2 2 1 4 31 35 7 1 1 1 1 0 0 1 0 0 0 1 0 0 0 1 1 1 1 1 1 6 6 3 1 2 1 2 6 6 9 3 2 1 0 1 1 0 0 0 1 0 0 0 0 0 1 2 3 2 15 23 7 4 2 3 5 5 1 1 1 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 1 1 1 1 1 1 0 1 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 1 0 1 1 0 1 2 1 0 1 3 2 1 11 8 11 7 59 34 11 15 6 5 5 3 1 2 1 1 1 1 2 4 3 73 100 45 1 1 2 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 72 72 dt 2H J 9 70 \| 72 71 m 2H \| 38 38 dt 2H J 9 25 \| 23 23 d 3H J 10 \| 22 21 t 1H J 26	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCOc1nc(N)c2[nH]c(=O)n(CCCCCN3CCN(CCO)CC3)c2n1	ir: 3 14 7 13 13 6 13 8 2 8 2 5 4 3 4 9 9 11 11 3 5 2 1 3 3 3 14 9 5 6 5 3 4 3 8 0 2 2 4 4 34 6 3 1 4 4 5 1 2 2 3 3 11 25 25 55 22 8 8 8 11 5 3 3 4 8 3 2 3 5 3 3 2 3 4 4 5 3 7 13 15 4 1 4 15 7 9 11 18 7 18 4 2 1 1 1 1 2 1 1 5 3 3 3 1 1 3 2 3 1 3 1 1 2 0 2 1 3 3 5 14 3 3 7 4 2 2 1 2 4 5 5 13 7 5 4 12 3 2 2 2 1 4 18 3 3 2 7 12 4 1 3 8 38 100 3 2 2 2 1 4 4 1 1 1 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 1 1 1 1 0 1 1 1 2 1 3 2 2 2 1 2 1 1 3 4 5 6 4 1 1 2 2 2 3 6 38 50 12 4 2 3 2 2 2 1 1 9 7 2 3 2 4 5 43 10 0 1 3 11 46 3 0 0 2 1 0 1 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 93 92 s 1H \| 66 66 s 2H \| 43 43 t 2H J 81 \| 40 40 t 2H J 72 \| 38 38 t 1H J 63 \| 37 36 m 2H \| 27 26 m 4H \| 26 25 m 2H \| 25 24 t 2H J 61 \| 24 23 t 4H J 47 \| 19 18 tt 2H J 69 83 \| 18 17 p 2H J 71 \| 16 14 m 6H \| 10 9 t 3H J 70	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C1C(c2c[nH]c3ccccc23)=C(c2cn3c4c(cccc24)CCC3)C(=O)N1c1ccccc1	ir: 3 5 10 3 4 6 4 3 4 4 4 5 4 5 2 4 5 3 3 4 3 3 1 4 4 4 23 45 0 7 8 9 3 3 4 5 10 2 4 23 50 15 52 100 10 4 6 41 60 13 5 23 9 3 3 4 2 2 4 3 2 1 2 6 5 4 7 11 19 13 10 4 3 3 6 11 6 7 8 6 3 3 4 8 10 6 4 4 2 2 4 3 2 5 8 3 9 6 5 6 7 14 14 5 6 5 6 12 63 8 13 9 6 7 6 3 3 3 3 2 2 3 4 3 2 3 6 5 5 7 6 4 5 6 6 9 35 13 8 4 11 11 18 56 18 8 6 2 3 3 4 21 27 12 11 13 62 9 5 10 46 7 3 2 2 3 2 1 2 3 2 1 2 3 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 2 2 2 2 2 3 3 3 4 4 3 3 3 5 7 8 22 25 37 47 47 24 15 8 5 5 6 4 2 4 3 2 2 3 3 2 2 3 3 2 2 3 5 11 22 20 8 4 3 3 3 2 2 4 3 2 2 2 2 2 2 2 2 1 2 2 2 1 2 3 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1; 1HNMR: 98 97 d 1H J 71 \| 79 78 dd 1H J 13 71 \| 78 78 d 1H J 72 \| 75 74 m 3H \| 74 74 m 2H \| 74 73 m 2H \| 73 72 m 2H \| 71 71 dq 1H J 10 71 \| 70 70 dd 1H J 14 79 \| 70 69 ddd 1H J 10 70 79 \| 40 39 m 2H \| 29 28 m 2H \| 21 20 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCCCCCCCCCCCP(=O)(OCC)OCC	ir: 10 7 1 4 2 1 3 3 2 3 2 8 5 24 26 20 18 5 3 2 3 1 0 1 1 0 1 2 2 0 2 3 11 9 3 8 10 3 8 15 37 30 9 8 10 10 21 13 20 13 9 4 5 6 4 3 5 43 11 12 7 3 2 3 4 52 27 18 10 10 9 16 25 26 70 30 44 41 20 29 100 71 12 1 2 3 0 1 1 1 0 1 2 3 9 5 3 3 5 2 4 4 3 4 2 9 22 14 32 30 29 35 35 35 35 21 20 21 29 43 42 11 8 11 6 4 5 5 5 4 11 8 5 3 3 3 4 2 1 4 2 0 1 1 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 1 0 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 1 1 1 1 3 6 6 9 24 18 9 10 4 8 5 9 17 29 49 49 42 15 9 5 4 2 1 1 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 41 40 dq 4H J 72 84 \| 18 17 m 2H \| 15 14 m 2H \| 14 13 m 8H \| 13 12 m 20H \| 9 9 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCN=C(C)N(C)C	ir: 26 14 13 12 16 8 21 19 9 15 22 11 9 13 4 7 10 4 8 7 6 2 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 3 3 13 7 1 3 4 2 0 2 4 2 1 3 5 3 2 7 19 6 5 4 5 6 6 4 7 11 7 15 14 21 18 8 20 14 8 12 18 14 8 11 6 4 1 4 4 4 9 10 8 8 26 20 9 11 41 6 6 9 2 5 3 1 2 5 5 5 9 25 16 13 4 7 9 16 18 34 31 11 16 14 13 22 26 9 4 7 13 17 14 10 14 11 7 15 53 72 20 100 45 9 4 6 4 4 8 7 10 34 97 47 14 5 7 3 4 3 1 1 3 2 0 1 3 2 0 1 3 2 1 2 3 2 0 2 3 1 0 1 3 1 0 2 2 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 0 1 2 2 0 1 2 2 0 1 3 1 0 1 3 1 0 2 2 1 0 2 2 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 3 4 3 10 7 7 7 7 7 5 3 10 6 8 5 14 16 18 38 14 9 4 2 3 3 2 1 2 3 1 1 2 2 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 0 1 2 1 0 1 2 1 0; 1HNMR: 32 32 t 2H J 78 \| 29 29 s 5H \| 20 20 s 3H \| 16 15 m 2H \| 15 14 m 2H \| 9 9 t 3H J 68	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1sc(I)cc1N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C	ir: 24 20 12 8 8 12 5 12 0 3 3 2 2 2 2 4 4 2 3 4 3 3 3 1 2 2 1 1 1 1 2 2 1 1 1 3 4 3 3 13 70 6 4 11 9 3 3 2 1 1 2 1 1 1 2 3 9 11 11 9 28 91 28 16 3 2 2 2 2 3 5 7 5 8 4 2 2 1 12 7 2 4 4 8 3 5 1 1 1 2 1 1 0 6 15 14 7 5 1 3 2 7 9 11 6 1 1 1 2 2 1 1 3 2 1 6 8 20 35 37 17 22 14 6 17 16 9 42 41 50 40 18 4 5 4 1 2 1 2 2 2 5 5 2 2 3 13 22 4 2 1 0 2 7 18 4 1 1 0 1 1 1 0 1 0 0 1 32 1 2 1 0 1 1 1 0 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 1 1 0 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 4 15 14 22 9 5 2 2 2 2 4 3 10 7 25 70 100 34 7 4 4 2 3 2 1 2 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 78 78 s 1H \| 40 40 s 3H \| 15 15 s 18H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
OCc1nc(C(F)(F)F)cs1	ir: 7 13 8 13 7 7 8 8 7 6 8 9 6 8 13 7 9 8 8 5 3 4 5 4 4 5 4 5 4 6 17 8 6 17 15 13 4 7 5 4 10 10 17 14 22 19 14 9 7 6 6 4 5 6 5 5 7 8 6 4 9 10 7 11 8 11 5 5 7 11 6 5 7 8 23 38 61 5 6 5 8 12 12 40 39 41 81 54 40 22 10 13 7 8 8 8 10 15 19 46 35 68 16 65 86 74 9 8 9 6 1 4 10 6 0 34 100 57 26 10 6 10 8 4 3 5 5 4 3 6 5 4 3 5 25 31 25 4 4 4 4 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 4 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 4 4 4 5 5 4 5 5 6 4 5 5 7 9 11 9 9 7 8 8 12 20 32 19 64 40 79 13 5 5 7 9 16 64 41 12 9 7 5 3 4 5 4 3 4 4 4 4 5 4 4 4 5 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4; 1HNMR: 82 81 q 1H J 20 \| 48 48 d 2H J 51 \| 34 33 t 1H J 52	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(NC(C(=O)O)C(Cc1ccccc1)C(=O)O)OCc1ccccc1	ir: 1 0 1 1 1 1 1 1 6 6 3 6 6 3 5 2 4 3 3 8 65 25 15 3 3 6 2 3 3 3 1 5 4 3 2 7 3 3 3 7 7 4 14 10 2 2 2 2 1 1 0 1 1 1 0 0 1 1 1 1 0 1 1 0 0 1 1 2 2 2 1 0 1 2 3 2 7 4 21 4 4 3 4 2 4 3 4 1 2 4 1 1 0 0 0 1 1 2 2 1 0 1 0 0 0 1 1 1 1 1 0 0 1 0 0 1 1 2 2 3 3 4 3 4 1 1 1 0 0 0 0 1 1 2 2 3 2 1 1 1 1 2 4 24 10 11 28 4 2 11 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 2 1 1 1 2 4 5 2 6 3 3 3 1 1 1 1 1 7 100 38 8 1 1 1 0 1 1 0 0 1 1 2 3 6 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 72 m 11H \| 72 71 d 1H J 88 \| 51 51 s 2H \| 46 46 m 1H \| 35 35 dt 1H J 77 98 \| 31 30 dd 1H J 76 144 \| 29 28 dd 1H J 77 145	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Nc1nc(OCCCO)nc2c1ncn2Cc1ccccc1	ir: 3 1 0 1 1 1 2 4 2 3 1 1 2 2 2 2 2 3 6 2 3 2 2 3 2 2 4 5 4 4 8 4 6 3 3 4 9 3 2 8 32 4 6 9 7 10 5 3 5 2 1 1 4 1 2 1 3 1 2 4 1 2 2 1 1 1 3 2 3 3 2 2 1 1 1 2 2 2 3 2 0 0 1 1 1 1 0 1 3 4 1 2 4 1 1 2 2 4 4 16 17 5 1 2 2 2 1 1 1 1 2 2 3 2 4 2 3 2 8 4 2 1 3 1 2 2 2 2 3 5 5 3 4 3 2 6 4 4 0 9 2 3 4 81 12 4 6 4 7 18 6 1 1 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 1 1 0 1 1 1 1 2 3 1 8 2 2 3 4 2 2 1 1 1 0 0 0 0 1 1 1 1 2 12 15 2 1 1 1 1 0 1 1 1 100 16 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 80 80 t 1H J 9 \| 73 72 m 3H \| 72 71 ddq 2H J 8 15 59 \| 70 70 s 2H \| 56 55 q 2H J 9 \| 44 43 t 2H J 80 \| 37 37 q 2H J 61 \| 29 28 t 1H J 57 \| 21 20 tt 2H J 62 80	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cccc2cc(C(=O)Nc3cccc(-c4cnc5ccccc5c4)c3)c(=O)oc12	ir: 1 1 1 1 2 3 2 3 2 1 2 1 1 1 1 1 1 2 2 3 3 2 3 2 2 2 2 15 3 1 2 6 1 5 2 1 2 10 8 1 1 1 2 2 4 6 4 8 27 100 10 4 3 2 1 1 8 7 2 1 9 4 1 1 2 1 3 4 5 4 3 6 1 1 1 1 12 2 1 3 2 2 3 3 3 1 0 0 1 1 0 2 14 4 3 1 2 5 1 1 2 1 1 2 3 2 4 2 3 4 4 2 3 2 0 1 4 3 1 6 2 2 1 11 3 1 1 4 3 0 2 1 1 1 1 1 3 6 5 16 3 2 2 18 13 7 8 18 10 6 9 4 23 4 47 11 7 5 30 3 2 2 4 6 12 1 1 5 2 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 29 62 32 21 7 4 2 2 1 0 1 2 1 0 1 1 1 1 1 1 1 0 4 3 12 8 13 12 16 1 2 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1; 1HNMR: 90 90 d 1H J 16 \| 83 83 m 2H \| 81 80 m 1H \| 79 79 m 1H \| 79 79 t 1H J 21 \| 78 77 m 2H \| 76 75 td 1H J 15 84 \| 75 74 ddd 1H J 14 21 75 \| 74 74 m 2H \| 73 72 dd 1H J 79 88 \| 71 71 dd 1H J 14 88 \| 40 39 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N#Cc1cc([C@H]2CC[C@@H](C(N)=O)N2)ccc1OCc1ccccc1F	ir: 1 1 1 1 1 1 1 1 0 2 2 3 1 7 13 6 4 13 12 2 4 5 3 2 2 2 2 1 3 5 18 6 19 14 6 7 5 5 2 5 7 4 29 6 4 5 3 3 8 4 3 1 3 8 15 37 3 4 3 3 6 14 13 22 13 3 5 20 11 12 6 1 1 2 2 2 8 7 5 1 1 1 3 1 1 2 4 3 1 5 3 1 3 3 1 2 10 22 14 9 8 5 11 3 4 10 5 7 6 2 2 2 2 4 7 3 2 2 2 3 5 4 8 9 3 2 1 2 2 5 5 5 3 1 1 1 2 5 1 1 1 4 8 5 2 22 3 3 2 7 9 3 4 3 5 10 5 100 25 9 10 1 1 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 1 0 32 1 1 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 2 2 1 1 1 3 2 3 6 4 5 74 18 7 4 2 3 1 1 1 1 1 0 0 1 1 2 1 11 13 20 62 7 2 2 2 1 1 1 2 4 7 33 4 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 76 75 dd 1H J 6 22 \| 75 74 dddt 1H J 8 17 35 87 \| 73 72 m 2H \| 72 70 m 2H \| 70 70 d 1H J 81 \| 68 67 s 2H \| 52 52 dd 2H J 9 35 \| 42 42 m 1H \| 37 36 m 1H \| 32 32 t 1H J 61 \| 22 20 m 2H \| 19 18 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)Cn1c(N)cc(=O)[nH]c1=O	ir: 1 3 3 1 1 2 1 1 1 2 3 2 1 1 1 1 1 2 2 2 2 1 1 1 1 2 1 1 2 10 14 13 2 2 2 3 3 3 2 2 1 2 1 1 1 2 1 2 8 6 7 1 1 2 1 0 1 1 1 1 1 2 2 0 1 1 2 1 2 2 2 1 1 1 1 0 1 1 2 1 1 1 1 1 1 1 1 0 1 3 5 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 2 2 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 2 1 1 0 1 1 2 2 3 1 1 1 1 1 1 1 3 4 4 1 1 1 1 1 0 0 1 1 0 4 26 20 6 2 3 11 10 3 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 4 2 3 1 2 3 4 2 2 2 0 1 2 1 100 59 8 1 1 1 1 1 7 4 4 1 1 0 0 1 1 0 0 1 9 15 11 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 99 99 s 1H \| 58 58 s 2H \| 44 43 s 1H \| 37 36 s 2H \| 10 9 s 9H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CS(=O)(=O)Nc1ccc2c(c1)OC(CNCCCOc1cccc(N)c1)CC2	ir: 29 11 8 12 3 15 5 8 4 8 3 3 2 3 3 4 5 5 4 2 0 1 2 1 3 2 4 2 2 6 5 4 4 3 3 5 3 4 4 3 2 6 3 5 5 11 16 23 15 4 4 5 4 3 7 8 9 2 8 7 5 5 2 4 1 3 6 11 23 16 6 5 5 10 4 3 2 3 2 2 3 5 5 2 2 2 3 40 21 8 3 2 1 4 2 2 19 3 2 2 2 7 30 11 7 4 4 10 13 11 18 12 14 6 7 3 2 10 5 6 6 13 4 3 3 2 3 7 2 2 3 0 1 5 4 8 13 4 2 1 2 2 2 4 1 2 1 1 0 3 7 10 7 30 22 5 23 37 3 5 2 6 39 9 2 1 1 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 1 1 1 2 5 2 1 2 1 2 1 2 2 2 4 10 7 34 9 9 14 22 18 2 2 2 1 1 1 1 0 1 1 0 1 1 1 1 9 52 48 43 10 5 2 4 4 7 31 27 9 100 67 11 2 1 2 1 0 1 1 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 1 0 0 1 1 0 1 1 1 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 74 s 1H \| 70 69 m 3H \| 67 67 ddd 1H J 12 21 82 \| 65 65 dd 1H J 7 15 \| 63 63 t 1H J 21 \| 61 61 ddd 1H J 12 22 79 \| 45 44 tt 1H J 33 49 \| 40 40 t 2H J 59 \| 39 39 s 2H \| 36 35 tt 1H J 51 60 \| 33 32 ddd 1H J 33 60 132 \| 30 30 ddd 1H J 33 60 132 \| 30 27 m 7H \| 22 21 dddd 1H J 48 60 88 138 \| 19 18 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1cncc(-c2ccccc2)n1	ir: 11 28 3 33 17 13 1 11 8 3 4 3 13 13 60 11 18 11 7 20 3 2 2 1 2 2 1 3 3 4 34 3 2 3 3 3 4 7 4 4 4 0 12 0 2 8 2 1 3 2 2 1 2 1 2 1 1 1 1 3 3 2 2 3 28 24 6 5 14 30 2 5 4 4 9 5 3 1 2 2 2 9 22 20 3 3 2 5 20 1 2 2 1 1 1 2 3 2 2 2 1 1 1 1 1 1 2 1 1 3 10 7 4 2 2 5 22 18 37 22 44 6 1 4 2 1 2 3 3 2 3 4 10 2 3 100 22 4 2 4 1 9 26 4 3 9 39 2 3 2 2 1 2 2 7 2 1 2 2 3 1 2 2 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 2 1 1 1 2 2 1 4 6 6 2 14 19 26 4 2 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 97 97 d 1H J 16 \| 91 90 d 1H J 16 \| 82 82 m 2H \| 75 74 m 3H \| 39 39 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCc1ncc(CN[C@@H](Cc2ccccc2)C(=O)OC)n1Cc1ccccc1Cl	ir: 4 2 1 2 2 2 5 3 2 1 3 1 2 3 2 1 1 1 1 1 1 2 1 2 1 1 2 2 2 3 5 10 8 2 4 15 16 10 69 23 44 24 28 5 19 5 21 10 8 4 3 1 2 2 2 3 1 1 1 1 2 1 6 1 2 1 3 7 8 7 2 2 6 11 15 9 12 3 6 3 1 1 1 2 1 2 5 3 11 22 35 10 2 4 4 3 4 3 18 8 5 1 3 2 3 2 13 11 7 8 6 13 13 17 15 17 26 27 25 19 18 6 8 6 11 4 4 2 2 2 3 5 2 3 8 29 16 6 3 3 4 14 27 29 15 2 2 12 20 4 2 3 2 2 1 0 1 1 1 1 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 1 1 0 0 1 1 1 2 3 6 3 4 5 9 11 10 7 6 5 4 14 7 22 37 25 23 100 38 55 16 4 3 2 2 1 1 1 1 1 1 1 2 1 1 3 1 23 15 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 73 m 1H \| 73 72 m 9H \| 67 67 d 1H J 9 \| 51 51 d 2H J 7 \| 41 41 ddd 1H J 9 53 161 \| 40 39 ddd 1H J 9 53 159 \| 38 38 dt 1H J 64 73 \| 37 36 m 3H \| 31 30 ddt 1H J 9 64 139 \| 28 28 ddt 1H J 9 64 139 \| 26 26 t 2H J 70 \| 17 16 p 2H J 67 \| 15 14 m 2H \| 10 9 t 3H J 72	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)c1cc2cc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)cc(CNS(C)(=O)=O)c2[nH]1	ir: 2 5 2 10 3 2 0 1 3 1 0 4 1 6 8 1 1 1 1 2 5 1 2 2 3 1 2 5 3 2 1 1 2 4 7 11 18 26 29 21 5 8 7 10 12 9 13 7 7 8 8 7 4 2 3 11 3 7 5 3 16 4 5 1 3 8 4 14 16 34 14 6 9 20 4 2 3 1 1 1 1 1 2 1 2 3 3 10 27 9 5 3 6 6 3 4 7 13 7 4 16 34 32 16 30 9 11 32 11 6 9 3 1 2 5 1 2 1 5 2 3 3 3 3 1 5 5 6 2 2 3 3 2 4 2 1 0 0 1 1 1 1 2 1 4 5 6 63 20 4 5 4 2 2 2 0 2 10 12 4 1 1 2 1 7 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 1 0 1 1 0 1 1 2 4 14 9 6 15 19 22 12 11 5 2 1 0 1 1 0 1 1 0 1 1 1 1 3 6 4 33 100 12 16 9 25 6 5 4 2 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 97 96 s 1H \| 78 77 t 1H J 22 \| 76 75 dt 1H J 9 20 \| 70 69 m 2H \| 68 67 d 1H J 84 \| 65 64 d 1H J 22 \| 63 62 s 1H \| 61 60 t 1H J 73 \| 59 59 s 2H \| 46 46 dd 2H J 9 73 \| 30 30 s 3H \| 17 16 m 2H \| 14 14 m 2H \| 14 14 s 10H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCNC(=O)c1ccc(-c2c(C#N)cc(OC)c(O)c2C#N)cc1	ir: 10 4 5 17 37 43 45 25 42 36 9 10 7 8 3 4 5 5 7 5 7 12 28 5 2 4 6 2 6 20 13 100 39 5 5 3 5 7 20 41 49 26 19 3 4 4 5 15 5 8 4 3 2 2 2 4 8 12 38 5 4 2 3 5 5 10 7 13 7 6 18 5 16 6 5 9 4 7 9 3 4 7 3 44 1 2 3 5 2 2 6 26 72 13 8 2 7 19 3 2 2 1 1 1 3 1 2 11 27 8 3 4 2 4 4 3 5 2 6 10 4 6 4 7 8 7 13 1 3 1 1 2 3 3 3 2 6 14 10 2 3 9 36 28 34 18 24 9 5 2 8 4 3 3 3 5 2 1 2 7 2 2 2 6 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5 25 3 0 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 5 2 2 3 1 1 2 4 2 10 10 12 21 49 17 6 7 2 1 3 1 10 13 1 3 3 2 1 1 2 1 2 1 2 2 3 16 59 22 21 4 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 80 79 m 3H \| 78 77 m 2H \| 74 73 s 1H \| 73 72 t 1H J 50 \| 39 39 s 2H \| 34 33 td 2H J 49 57 \| 16 15 p 2H J 60 \| 14 13 h 2H J 66 \| 10 9 t 3H J 67	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Nc1nccc(Oc2ccc(NC(=O)NC(=O)Cc3ccc(F)cc3)cc2F)n1	ir: 2 2 1 1 3 2 2 2 3 3 2 1 3 2 1 2 3 2 2 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 1 1 1 1 1 2 1 2 1 2 2 2 4 3 3 8 11 8 12 11 3 2 1 2 1 1 1 2 4 2 3 1 2 1 1 2 1 1 1 1 1 1 1 1 1 1 1 2 2 2 1 1 1 1 1 1 1 4 1 1 2 3 2 1 1 1 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 3 1 1 1 2 3 2 3 5 9 16 8 6 8 7 17 17 38 19 4 16 5 2 0 1 2 2 1 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 3 3 11 5 2 2 3 1 1 1 1 1 1 1 1 1 1 1 2 2 12 5 2 2 2 2 8 9 2 2 3 3 7 100 5 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 100 99 s 1H \| 93 92 s 1H \| 81 80 d 1H J 48 \| 75 74 dd 1H J 47 83 \| 74 73 ddt 2H J 8 33 80 \| 72 71 m 4H \| 67 66 s 2H \| 62 62 d 1H J 48 \| 37 37 t 2H J 9	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=CCc1ccc(F)c(Oc2ccccc2)c1	ir: 0 0 1 0 1 1 0 1 2 1 2 1 2 3 1 2 2 2 1 2 1 1 1 1 1 1 1 1 2 2 2 2 1 1 1 1 2 3 6 14 16 20 7 3 2 3 1 1 0 1 1 1 1 6 9 5 3 1 2 1 1 3 1 2 5 2 2 6 10 14 6 6 1 1 2 2 1 1 4 1 1 1 0 1 2 4 1 2 1 1 1 1 1 1 1 1 1 5 4 2 4 1 1 3 3 1 1 2 1 1 1 1 1 1 1 1 2 1 2 1 2 1 1 1 1 1 1 2 1 1 1 0 1 1 7 12 0 1 1 0 1 13 12 4 4 6 3 2 11 8 8 22 13 5 3 1 0 1 1 5 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 3 4 8 5 35 100 29 20 6 5 2 2 1 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 98 97 t 1H J 62 \| 74 73 m 2H \| 71 71 ddd 1H J 14 60 74 \| 71 70 m 2H \| 71 70 m 2H \| 69 68 m 1H \| 38 38 dt 2H J 8 61	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N#Cc1ccccc1C1(C#N)CCCC1	ir: 0 7 15 6 0 7 13 6 0 9 13 6 4 11 13 5 2 14 14 6 3 10 12 5 6 12 11 5 5 11 14 4 6 11 10 3 5 16 11 3 11 35 17 27 37 13 9 2 7 13 8 1 7 14 7 1 7 14 7 0 8 13 6 3 10 14 6 2 9 12 6 3 11 15 8 4 9 11 4 3 9 11 5 4 11 11 5 4 11 10 3 5 12 10 3 5 12 9 3 5 12 9 2 6 14 9 8 12 22 10 1 9 18 16 4 10 15 8 2 8 14 8 2 9 14 6 4 10 26 11 3 9 11 5 3 10 35 62 6 13 13 8 16 16 10 4 5 10 11 23 40 17 10 3 6 12 9 2 6 12 8 2 6 12 8 1 6 12 7 1 7 13 7 1 7 12 6 2 6 92 78 5 11 11 6 3 8 11 5 3 9 11 5 3 9 10 4 4 10 10 4 4 10 9 4 5 10 9 3 5 11 9 3 5 11 8 2 6 11 8 2 6 12 7 2 7 12 7 1 7 12 7 2 7 12 6 2 8 11 6 3 8 11 5 3 8 10 5 3 9 10 5 4 9 10 4 4 10 9 4 5 10 9 4 5 10 9 4 5 11 9 3 7 11 10 6 14 16 11 2 7 16 9 8 31 15 18 100 71 25 11 6 8 11 6 4 8 11 6 4 8 10 5 4 8 10 5 4 9 9 5 5 9 9 4 5 9 9 4 5 10 9 4 5 10 8 4 6 10 8 3 6 10 8 3 6 11 7 3 7 11 7 2 7 11 7 3 7 11 6 3 7 10 6 3 8 10 6 4 8 10 5 4 8 9 5 4 9 9 5 5 9 9 5 5 9 8 4 5 9 8 4 6 10 8 4 6 10 8 4 6 10 7 3 6 10 7 3 7 11; 1HNMR: 77 76 dd 1H J 13 58 \| 75 74 m 1H \| 74 74 m 2H \| 24 23 m 2H \| 21 20 m 2H \| 20 19 m 2H \| 19 18 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccc(S(=O)(=O)Cc2nc(-c3ccc(C(=O)NCc4cccnc4)cc3)oc2C)c(C)c1	ir: 18 14 5 21 15 13 13 12 12 30 15 9 4 7 13 14 14 5 2 3 13 30 22 13 13 7 12 5 4 14 4 24 24 29 47 13 8 6 7 8 9 38 17 40 8 9 12 9 5 7 5 1 4 25 19 5 7 11 4 4 6 1 36 22 40 26 7 4 16 13 30 18 29 19 11 4 5 6 7 6 12 11 14 38 23 7 11 48 13 27 16 15 11 17 31 9 4 6 12 15 3 3 16 14 6 5 5 10 5 6 19 20 33 12 10 12 11 16 24 36 31 13 19 18 20 9 20 27 12 13 17 14 6 5 9 9 10 20 41 43 10 26 68 83 63 24 11 8 4 30 26 21 7 19 11 8 14 6 37 44 8 30 3 1 1 1 1 3 22 3 1 1 1 0 0 1 1 0 1 1 1 1 0 1 0 1 0 1 0 0 1 0 0 0 1 0 0 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 1 0 1 1 1 0 0 0 1 1 0 0 1 0 1 0 0 0 0 0 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 1 1 1 1 0 1 0 0 1 1 1 1 1 1 1 1 1 1 2 3 2 6 6 5 3 16 10 6 6 6 8 11 5 18 36 30 40 67 100 68 22 1 7 6 4 1 3 3 1 1 2 2 1 1 4 4 4 3 6 15 20 55 62 35 13 9 6 3 3 1 1 1 1 1 0 0 0 1 0 1 0 1 0 1 1 0 1 1 0 0 0 0 0 0 1 0 0 0 0 1 1 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 87 86 dq 1H J 10 21 \| 85 84 ddd 1H J 13 20 42 \| 82 82 t 1H J 66 \| 81 81 m 2H \| 79 79 m 2H \| 78 77 m 2H \| 73 72 dd 1H J 43 78 \| 72 72 ddd 1H J 9 22 92 \| 72 71 d 1H J 18 \| 46 46 s 2H \| 46 45 dt 2H J 9 66 \| 25 25 s 3H \| 24 23 s 3H \| 23 22 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1nc(S(=O)(=O)Cc2ccccc2)nc(C)c1Br	ir: 3 2 1 1 1 1 0 5 6 0 0 1 4 3 1 2 2 1 0 1 3 1 2 1 1 0 0 1 1 1 2 1 2 1 1 1 2 2 11 14 1 0 2 4 2 1 1 1 1 0 1 1 1 0 1 2 1 0 1 1 1 1 1 1 1 1 4 4 4 6 2 1 1 0 1 1 1 1 1 1 1 1 1 4 3 2 1 1 4 2 3 1 0 0 1 1 1 1 1 1 1 1 1 1 0 1 1 2 4 3 4 2 0 1 1 1 0 1 2 1 0 1 2 1 1 2 2 1 0 1 1 1 0 1 2 3 2 1 1 0 0 2 3 25 8 6 100 31 2 0 1 2 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 2 1 0 1 2 3 2 1 1 1 1 1 4 6 1 9 7 5 3 2 1 1 1 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 74 74 m 5H \| 74 73 m 1H \| 47 47 d 2H J 7 \| 25 25 s 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](c2nnc([C@@H]3CC[C@@H]4CN3C(=O)N4OCc3ccccc3)o2)C1	ir: 10 5 4 5 2 6 5 3 2 15 3 4 6 9 2 2 1 3 3 2 5 5 6 4 11 7 10 10 3 8 27 66 34 59 16 33 15 14 32 22 62 19 3 2 4 2 3 4 1 2 6 8 4 2 1 3 5 3 5 4 1 4 7 9 8 26 5 2 6 5 2 2 2 5 2 4 2 1 3 1 1 2 4 3 2 2 6 4 4 26 9 3 2 4 4 5 2 5 10 4 1 1 3 2 7 5 15 27 5 3 8 6 9 7 10 6 14 15 9 19 15 23 15 23 21 13 6 8 4 9 3 15 30 5 16 11 5 3 3 1 4 15 29 61 22 72 67 8 6 46 13 12 16 16 4 1 1 1 1 1 1 0 0 1 0 0 0 1 1 0 1 0 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 1 1 1 0 1 1 0 0 0 0 0 0 1 1 1 0 0 1 0 1 1 0 1 1 0 0 1 1 1 1 0 1 1 2 2 2 2 2 4 10 8 4 4 4 8 13 5 20 42 15 23 100 10 7 4 2 1 1 3 1 2 1 1 1 1 2 1 2 1 0 1 1 2 3 26 92 36 19 4 3 2 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 73 m 5H \| 49 48 m 2H \| 47 46 dd 1H J 54 81 \| 41 40 dtdt 1H J 17 40 73 82 \| 39 38 m 3H \| 36 35 m 1H \| 32 31 m 1H \| 24 18 m 10H \| 17 16 dtd 1H J 45 71 117 \| 14 14 s 7H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCc1cn([C@H]2C[C@H](O)[C@@H](CN(C)C(=O)Cc3ccccc3Br)O2)c(=O)[nH]c1=O	ir: 4 3 7 3 6 4 5 3 2 3 5 4 4 6 7 5 5 7 5 8 7 5 6 5 2 5 5 4 8 5 9 14 11 6 5 4 10 3 6 4 11 5 9 8 7 3 4 6 4 1 3 4 6 8 97 100 11 7 4 4 8 4 4 2 4 4 2 2 6 4 4 5 7 4 2 3 3 3 2 1 4 3 20 5 5 12 2 3 6 13 14 3 20 5 4 16 18 17 31 9 13 5 7 4 6 11 4 3 7 5 2 6 10 5 6 8 6 4 3 4 6 6 6 9 4 3 7 4 6 9 3 8 5 5 6 9 8 2 1 2 5 20 5 2 2 3 6 19 39 3 5 37 30 4 10 33 8 0 2 3 3 0 2 12 21 42 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 2 1 1 1 3 2 3 2 3 2 1 2 2 5 5 6 3 4 4 6 5 5 8 12 5 28 22 19 20 44 38 18 9 49 67 10 6 1 2 2 3 1 1 2 2 1 1 1 3 8 20 32 9 10 10 3 2 1 1 2 2 1 2 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 88 88 s 1H \| 76 75 m 1H \| 75 74 q 1H J 14 \| 74 74 m 1H \| 73 73 m 2H \| 62 61 m 1H \| 43 42 m 2H \| 42 42 dtt 1H J 16 43 59 \| 37 36 ddd 1H J 16 43 119 \| 36 35 d 2H J 8 \| 32 31 m 1H \| 29 29 s 2H \| 25 24 m 1H \| 22 21 m 3H \| 12 11 t 3H J 76	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(CN2Cc3c(F)c(N[C@@H]4CCCC(F)(F)[C@@H]4N)nc(Cl)c3C2=O)c(OC)c1	ir: 0 1 1 1 1 1 1 1 1 2 2 1 1 2 3 5 23 4 1 4 9 5 6 5 7 2 5 2 1 1 2 1 1 1 1 1 1 1 1 2 2 9 24 7 7 5 2 1 2 1 1 1 1 2 2 2 4 2 1 2 1 4 5 4 2 4 10 10 4 6 2 1 5 16 8 4 1 2 1 3 6 2 5 2 1 1 2 4 2 3 2 1 2 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 2 2 2 4 2 3 1 3 2 3 3 4 10 7 2 3 4 3 4 1 5 9 10 12 8 15 2 4 2 3 3 26 6 1 2 2 1 2 1 1 2 2 2 2 5 5 100 15 0 1 2 1 0 4 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 1 1 2 1 1 2 1 1 1 2 1 2 3 3 2 3 6 2 1 0 1 1 1 1 1 1 1 3 3 3 7 10 5 3 3 2 3 8 11 14 4 24 5 3 2 3 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 71 71 dp 1H J 9 85 \| 66 65 m 1H \| 65 65 s 1H \| 64 63 dd 1H J 47 85 \| 50 49 d 2H J 53 \| 47 46 d 2H J 10 \| 41 40 dddt 1H J 28 40 53 107 \| 38 38 d 6H J 40 \| 36 35 m 2H \| 35 34 dqd 1H J 39 66 82 \| 22 18 m 3H \| 18 17 m 2H \| 17 16 m 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(OCc1ccccc1)N1CCC[C@H](NC(=O)C23CC4CC(C2)C(=NO)C(C4)C3)C1	ir: 12 20 13 20 17 55 22 9 5 10 15 5 4 3 8 7 1 3 3 7 19 17 16 11 5 3 4 3 5 11 16 4 4 20 12 19 19 14 21 16 18 16 5 0 2 3 2 2 4 11 6 3 2 4 3 2 13 10 2 0 2 3 2 5 10 12 18 3 3 7 3 4 4 6 17 100 11 12 11 3 5 3 2 1 2 4 2 2 4 16 6 3 20 9 3 5 8 31 18 6 4 5 8 6 11 7 23 15 12 21 15 9 3 13 3 4 4 12 6 7 4 12 15 10 11 7 6 6 11 8 4 4 4 3 6 39 12 16 6 5 5 6 38 15 6 9 76 44 60 7 12 23 6 3 2 2 2 1 1 3 2 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 0 2 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 2 2 2 8 10 8 3 4 3 5 9 11 10 36 19 16 35 18 9 4 1 2 5 4 42 16 4 2 1 2 2 1 1 2 2 1 1 5 11 31 19 12 5 2 2 2 2 1 1 2 2 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 2 1 0 1 2; 1HNMR: 84 84 s 1H \| 74 73 m 5H \| 60 59 d 1H J 93 \| 52 51 s 2H \| 39 38 ddddd 1H J 18 32 48 62 94 \| 38 37 dd 1H J 18 121 \| 35 34 m 2H \| 34 34 ddd 1H J 36 58 122 \| 29 28 p 2H J 50 \| 22 21 hept 1H J 53 \| 21 20 d 4H J 48 \| 20 19 d 2H J 53 \| 19 18 m 2H \| 18 18 t 4H J 53 \| 18 17 m 1H \| 16 15 ddt 1H J 63 97 127	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(=O)O[C@H](C)CC#CCOCc1ccccc1	ir: 9 10 9 4 10 6 4 8 4 5 5 5 3 3 3 3 3 4 8 11 9 13 6 1 1 2 2 4 3 7 5 10 3 3 3 5 5 13 20 21 30 29 5 5 6 6 3 1 3 3 4 3 3 2 2 1 2 4 2 2 2 4 5 8 18 59 20 29 22 33 7 16 10 7 6 12 17 16 8 14 8 5 4 1 2 3 1 3 27 22 2 2 2 1 2 2 3 6 3 13 16 7 2 2 4 2 4 2 5 3 1 6 4 3 2 4 4 8 6 9 12 5 22 12 11 5 2 8 13 4 5 5 9 14 7 21 9 6 3 4 5 4 41 87 81 80 28 11 4 2 4 5 4 3 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 0 1 1 1 0 1 1 1 0 1 1 2 0 1 1 0 0 1 1 0 0 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 4 4 6 2 3 4 6 2 2 3 7 5 2 8 29 38 41 47 100 91 58 17 4 6 4 1 0 2 2 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1; 1HNMR: 74 73 m 5H \| 49 48 qt 1H J 43 59 \| 46 46 t 2H J 8 \| 42 41 t 2H J 25 \| 27 27 ddt 1H J 26 42 117 \| 25 24 ddt 1H J 25 42 119 \| 21 20 s 2H \| 14 14 d 3H J 57	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(NO)c1ccc(/C=C(/CNC2CCNC2)COc2cccc3ccccc23)cc1	ir: 10 7 10 14 6 8 7 9 8 6 9 8 9 11 11 15 12 7 18 12 8 6 8 5 5 6 11 11 14 12 28 9 13 35 42 6 10 27 39 33 14 21 12 21 20 49 33 16 21 15 13 24 6 0 8 9 14 61 26 20 13 16 15 14 16 11 22 34 18 12 24 23 28 7 16 15 8 9 8 6 12 10 13 5 6 5 5 11 4 8 10 12 5 19 21 26 65 50 14 12 10 34 19 12 11 27 38 11 24 23 22 25 28 30 32 27 29 8 11 9 7 6 13 27 15 20 8 8 6 9 26 18 8 6 8 12 21 12 5 5 6 6 11 79 33 43 15 10 8 6 16 17 7 4 7 5 4 6 16 7 4 3 3 6 9 2 6 3 3 3 3 4 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 4 3 3 3 3 3 4 4 3 5 4 5 6 6 6 5 6 7 7 7 14 13 22 25 100 31 15 9 10 8 6 9 78 20 7 6 6 4 6 8 7 11 25 52 57 24 23 12 31 22 10 13 8 3 3 4 4 3 3 4 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3; 1HNMR: 94 94 d 1H J 35 \| 93 93 d 1H J 35 \| 81 81 m 1H \| 80 79 m 2H \| 78 78 dt 1H J 17 83 \| 76 75 m 2H \| 75 74 m 1H \| 74 74 s 1H \| 74 74 m 2H \| 70 70 m 1H \| 65 65 p 1H J 13 \| 45 45 d 2H J 15 \| 35 34 ddd 1H J 13 45 156 \| 34 33 ddd 1H J 13 46 157 \| 32 31 m 2H \| 31 30 dt 1H J 46 62 \| 30 29 m 2H \| 28 27 m 1H \| 20 19 m 2H \| 17 16 dtd 1H J 18 36 133	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cc(Nc2nccc(C(F)(F)F)n2)cc(-c2ccc(CN3CCCC3=O)nc2)c1	ir: 2 1 2 4 5 2 1 3 3 3 1 2 5 6 2 2 4 8 11 9 3 6 9 4 0 3 5 10 12 5 4 2 5 2 3 2 3 7 7 4 2 3 3 1 2 2 1 1 1 2 2 1 3 8 26 29 94 18 13 8 5 3 4 3 2 5 5 14 13 11 8 12 11 23 4 1 11 2 2 2 1 1 4 5 1 0 1 1 3 2 22 7 1 20 11 24 7 11 6 7 7 3 1 9 5 2 3 1 0 1 2 2 2 2 6 11 8 8 9 13 4 7 6 2 2 3 4 5 6 11 5 4 1 1 2 0 1 3 3 1 1 2 4 52 25 5 8 17 17 60 100 19 8 7 5 4 31 18 2 3 3 6 33 4 2 6 5 1 1 1 1 0 0 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 1 0 1 1 1 0 1 3 3 2 1 2 2 2 2 5 7 6 8 39 48 15 4 3 1 2 1 1 1 1 1 1 1 1 1 2 3 2 2 3 1 7 7 8 25 29 24 6 3 1 1 1 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 88 87 d 1H J 19 \| 86 85 d 1H J 37 \| 83 83 s 1H \| 77 77 dd 1H J 18 82 \| 76 76 t 1H J 22 \| 76 75 t 1H J 27 \| 74 74 dt 1H J 10 84 \| 74 73 dq 1H J 17 35 \| 72 72 t 1H J 24 \| 46 46 d 2H J 10 \| 36 35 dd 2H J 36 46 \| 24 23 t 2H J 58 \| 23 23 s 3H \| 20 19 tdd 2H J 32 42 56	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(CC(=O)O)c(NC(=O)OC(C)(C)C)cn1	ir: 8 12 18 6 7 7 13 9 6 15 21 12 7 11 9 12 17 9 8 13 89 99 28 8 13 21 16 14 5 4 5 2 14 15 9 13 45 2 70 12 54 33 15 17 8 10 13 4 6 5 4 3 3 4 3 2 4 5 5 3 3 5 5 3 3 3 8 11 15 5 2 2 2 5 3 4 6 9 47 49 8 5 7 4 11 7 14 6 6 5 2 3 12 4 5 5 9 13 22 18 6 13 12 4 3 2 4 3 3 5 10 4 21 7 4 5 3 7 27 11 16 12 6 4 5 3 4 11 10 9 22 10 4 5 5 4 2 6 6 0 59 43 9 100 13 5 3 6 8 50 16 4 28 25 25 15 7 4 2 5 3 27 2 4 2 0 2 3 2 0 2 3 2 0 2 3 2 1 2 3 2 1 2 3 2 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 2 3 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 3 2 1 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 2 2 2 2 2 2 2 1 2 3 3 2 2 3 4 4 4 4 3 5 4 3 4 2 3 3 5 16 22 13 21 18 9 5 6 2 3 5 3 2 44 22 3 3 3 3 3 3 3 3 8 8 18 4 13 55 75 10 8 4 6 3 2 2 3 2 1 2 2 3 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 1 2 2 2 2 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2; 1HNMR: 84 83 s 1H \| 71 71 s 1H \| 68 67 t 1H J 8 \| 39 39 s 3H \| 37 36 d 2H J 9 \| 15 14 s 9H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1[nH]c(C=O)c(CCCS(C)(=O)=O)c1C(=O)O	ir: 2 1 1 5 3 4 3 1 1 1 1 1 1 1 2 2 1 1 2 2 4 1 1 1 4 13 14 2 1 1 1 1 1 1 1 1 3 3 2 1 1 1 1 1 1 1 1 1 2 7 5 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 3 5 2 1 1 1 1 1 2 11 4 6 3 1 1 1 1 1 0 31 0 0 2 2 0 0 1 1 0 1 1 1 0 1 1 2 16 5 5 4 8 3 8 3 3 2 1 1 1 1 2 3 2 3 2 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 2 0 1 1 0 0 1 1 0 1 1 3 1 1 1 15 1 1 1 1 1 2 4 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 3 1 1 1 2 2 1 0 1 1 1 1 1 6 8 2 2 1 1 1 1 1 1 1 1 1 9 100 8 3 1 0 1 1 1 0 1 1 1 1 1 1 1 2 8 6 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 99 99 s 1H \| 98 97 s 1H \| 38 37 t 2H J 92 \| 32 31 t 2H J 102 \| 30 30 s 3H \| 24 24 s 3H \| 23 21 tt 2H J 92 101	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=CCN(CC=C)c1cnc(C(O)C(C)(C)N2CCC3(CC2)CC(C)NC3=O)cn1	ir: 3 6 2 3 4 5 5 23 28 8 12 11 6 4 4 5 4 6 9 2 6 4 5 3 5 4 5 5 10 21 21 5 3 2 2 2 2 2 2 1 1 2 3 3 3 2 2 1 1 2 1 1 4 5 2 3 3 2 2 1 2 8 5 3 2 2 2 5 6 14 17 14 12 14 4 4 2 4 3 3 2 4 2 4 6 11 18 16 11 8 12 7 4 3 2 4 2 2 1 2 6 7 3 4 7 5 4 3 2 3 3 2 14 5 1 3 3 4 3 4 5 10 8 11 6 7 3 3 2 2 4 3 7 8 4 4 3 10 14 9 8 1 10 9 2 1 1 1 1 2 1 3 9 45 17 5 2 1 2 2 3 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 1 0 0 1 1 1 0 1 1 1 0 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 3 2 3 2 2 6 6 7 6 7 4 7 6 2 2 3 4 5 3 6 28 100 4 2 0 1 2 0 1 1 1 1 1 2 3 4 11 43 5 4 1 1 2 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1; 1HNMR: 82 82 s 1H \| 78 78 s 1H \| 62 61 d 1H J 75 \| 59 58 ddt 2H J 66 114 168 \| 53 52 m 2H \| 51 50 m 3H \| 40 40 d 1H J 70 \| 40 39 dt 4H J 14 66 \| 37 36 dqt 1H J 38 50 77 \| 30 29 ddd 2H J 35 62 126 \| 28 27 ddd 2H J 35 62 126 \| 22 21 ddd 2H J 34 61 136 \| 19 19 d 2H J 40 \| 19 18 ddd 2H J 34 61 134 \| 15 14 d 3H J 16 \| 14 14 d 3H J 14 \| 12 11 d 3H J 49	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(OC(C(=O)O)C(OC)(c2ccccc2)c2ccccc2)nc(OC)n1	ir: 1 1 1 2 2 2 2 2 2 2 4 3 2 4 4 3 3 3 3 5 7 13 20 9 2 2 3 3 3 3 3 3 3 5 3 4 30 27 5 4 4 6 5 4 2 2 1 1 1 2 2 2 2 2 1 1 3 2 2 2 2 1 2 4 12 9 5 10 8 8 11 2 2 4 3 2 2 5 12 18 4 5 3 3 2 2 2 2 2 2 2 1 2 1 2 2 2 2 2 2 2 2 2 2 1 1 1 1 1 1 2 2 5 6 2 2 2 3 3 3 2 2 2 2 2 2 8 5 3 2 3 2 2 2 3 12 2 2 2 1 1 3 6 12 100 83 1 4 3 1 1 2 4 3 1 2 5 8 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 1 2 1 1 2 2 1 1 2 1 1 1 2 2 2 2 2 3 2 3 4 6 23 11 5 2 1 2 3 2 0 33 57 5 2 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 97 97 s 1H \| 74 73 m 9H \| 73 72 m 2H \| 59 59 s 1H \| 56 56 s 1H \| 40 40 s 3H \| 40 39 s 3H \| 32 32 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=Cc1ccc(-c2nc3nccn3cc2-c2ccsc2)cc1	ir: 3 1 1 1 1 1 2 1 2 2 6 2 1 1 2 2 4 12 6 28 8 2 2 1 2 2 2 6 5 14 10 4 6 5 14 18 8 9 2 4 33 29 35 7 3 3 2 1 3 7 5 1 4 4 8 14 19 32 5 2 1 2 1 1 2 6 25 15 7 15 4 13 6 2 1 0 0 1 1 1 1 0 1 1 1 1 1 1 1 1 2 3 3 10 13 12 4 6 8 2 3 5 28 6 2 7 14 1 19 1 1 0 0 1 1 1 2 2 3 1 1 1 1 2 2 3 7 16 4 2 4 3 5 2 1 1 8 14 3 1 2 9 9 20 3 3 7 4 4 37 15 16 3 3 1 1 3 1 1 0 0 1 1 12 0 0 0 1 0 0 0 1 4 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 2 3 16 4 14 34 100 44 10 6 5 15 26 9 2 2 2 1 1 0 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 100 100 s 1H \| 88 88 s 1H \| 79 79 m 2H \| 78 78 m 2H \| 78 77 d 1H J 31 \| 76 76 d 1H J 31 \| 75 74 t 1H J 17 \| 74 74 dd 1H J 17 53 \| 72 72 dd 1H J 17 54	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cn1cnc(C#N)c1	ir: 0 2 2 2 1 1 5 3 0 1 2 1 1 1 2 1 1 1 2 1 1 4 10 7 2 3 3 2 2 2 2 1 2 7 35 36 100 9 2 2 1 0 1 15 8 4 2 1 1 2 2 1 1 2 1 0 1 2 12 6 2 1 3 8 9 2 2 1 2 3 5 4 2 2 9 4 22 28 10 3 2 2 2 5 4 2 1 1 5 11 4 2 9 12 3 7 52 44 6 4 3 2 1 2 2 2 2 11 38 7 14 10 8 3 8 7 11 4 3 25 22 6 2 8 6 3 2 2 2 1 3 3 3 1 1 1 2 1 1 3 8 20 20 2 2 0 1 2 2 1 1 1 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 0 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 0 1 4 3 2 4 4 4 1 2 3 2 1 1 4 4 2 6 11 15 36 51 25 53 5 7 6 9 2 2 2 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 76 75 m 1H \| 75 74 d 1H J 17 \| 37 37 d 3H J 7	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(OC)c(Cl)c(-c2cc3[nH]nc(-c4ccc(OCCN(C)C)cc4)c3cn2)c1Cl	ir: 2 5 1 10 13 18 6 3 4 4 4 2 1 3 3 9 12 15 8 6 2 2 2 1 2 2 2 2 3 4 6 2 3 1 3 26 29 77 16 2 6 2 8 3 1 6 4 2 2 1 2 1 8 11 4 24 21 9 2 1 5 5 6 4 9 6 6 14 4 15 4 4 5 7 3 1 2 2 3 3 2 3 8 12 14 2 3 4 6 2 2 4 8 15 3 5 46 1 4 6 6 5 7 17 6 4 1 1 2 64 3 1 2 1 1 1 2 3 5 8 26 7 4 7 4 5 3 34 1 2 3 1 1 9 3 10 9 6 1 1 1 1 1 4 2 2 7 7 6 2 3 7 15 6 2 3 1 1 2 4 3 3 2 100 2 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 2 1 3 5 9 6 25 65 16 6 4 3 3 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 3 2 2 1 2 5 43 5 5 5 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 89 89 s 1H \| 79 79 s 1H \| 78 77 m 2H \| 71 70 m 2H \| 66 66 s 1H \| 42 41 t 2H J 66 \| 39 39 s 6H \| 29 29 t 2H J 66 \| 25 25 s 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1	ir: 4 2 3 1 2 3 4 5 10 3 6 2 2 3 1 2 2 1 1 3 2 2 3 2 2 3 2 4 8 8 15 21 5 4 7 7 8 17 30 74 45 18 11 4 4 9 27 11 8 5 10 6 3 1 2 1 5 10 22 17 26 18 8 4 25 12 4 4 14 13 10 8 6 16 20 16 7 18 20 30 29 6 5 5 5 3 1 1 4 6 7 1 2 2 3 8 7 5 4 3 2 2 1 4 3 3 3 8 7 5 5 4 3 2 2 5 5 16 6 18 26 15 11 11 10 10 10 22 9 15 20 19 40 67 35 25 7 8 2 4 8 7 19 56 39 24 72 75 11 5 4 5 6 3 2 0 0 1 1 1 0 1 0 0 1 1 0 0 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 1 1 0 1 0 1 1 2 1 1 1 2 1 5 3 4 7 9 5 5 11 34 13 16 100 37 17 4 2 3 2 1 3 2 2 2 4 11 12 33 25 9 8 6 9 7 22 69 41 39 10 13 3 2 2 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 72 m 10H \| 71 70 d 1H J 96 \| 52 51 m 2H \| 45 44 dt 1H J 71 97 \| 44 43 d 2H J 57 \| 36 35 m 1H \| 31 31 ddt 1H J 9 70 142 \| 29 28 ddt 1H J 9 71 143 \| 20 19 dddt 1H J 15 53 69 136 \| 15 14 dqd 1H J 54 79 133 \| 12 11 dqd 1H J 55 80 132 \| 10 9 dd 3H J 15 70 \| 9 8 td 3H J 16 80	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)O[C@@H]1CC[C@@H](c2ccc(O)cc2O)CC1	ir: 1 3 2 1 1 4 3 1 1 2 2 2 1 2 1 1 1 1 1 2 2 2 1 0 0 1 1 1 1 1 1 0 0 1 1 1 0 1 1 0 1 1 1 0 0 1 1 1 1 1 1 0 1 3 6 3 1 1 1 0 1 1 1 1 1 9 5 3 1 1 1 1 1 1 2 2 3 4 3 6 4 6 32 11 4 2 1 1 2 2 2 1 1 2 4 2 1 1 1 1 1 1 0 1 1 1 2 1 0 9 1 3 2 1 1 1 3 3 1 4 1 1 1 1 2 1 1 4 2 2 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 2 5 14 1 0 5 1 2 8 1 1 1 0 0 1 1 1 5 1 1 0 0 1 1 1 0 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 1 1 2 1 1 1 2 1 1 1 1 1 1 2 1 1 2 2 1 2 3 3 4 4 5 2 1 0 2 3 0 100 36 1 4 2 1 0 1 1 0 0 0 1 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 70 69 dd 1H J 8 89 \| 67 67 s 1H \| 65 64 dd 1H J 24 88 \| 63 63 d 1H J 23 \| 60 59 s 1H \| 48 48 tt 1H J 35 62 \| 43 42 q 2H J 64 \| 29 29 ttd 1H J 7 43 71 \| 21 19 m 4H \| 18 17 m 4H \| 13 13 t 3H J 64	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc2nccc(CCC3(O)CCC(=O)CC3)c2n1	ir: 2 1 3 1 1 2 4 6 3 10 6 6 37 12 9 8 10 10 6 19 39 31 27 23 9 21 12 15 8 3 14 6 3 4 3 2 1 20 1 1 16 2 0 4 4 1 4 2 1 1 3 48 19 8 29 9 25 19 20 7 3 3 0 3 13 1 2 2 1 1 2 2 2 10 12 3 2 8 7 12 26 6 4 1 1 15 6 15 3 2 5 5 2 20 16 7 31 7 23 39 6 5 4 6 7 7 6 2 5 15 26 19 6 22 18 4 11 6 13 10 10 6 24 13 8 3 3 4 3 3 2 1 1 4 38 8 10 7 4 3 1 6 27 51 100 20 2 3 2 2 1 1 4 16 3 3 2 2 3 1 1 0 4 1 1 0 0 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 1 0 0 0 0 0 0 1 1 1 0 1 0 0 0 1 1 1 1 1 0 0 0 0 1 0 0 1 1 1 0 1 1 1 1 1 2 3 5 9 6 2 4 2 5 0 3 5 22 34 7 46 44 12 4 29 99 23 7 2 1 1 0 1 1 1 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 86 85 d 1H J 49 \| 82 81 d 1H J 81 \| 72 72 dt 1H J 9 49 \| 70 70 d 1H J 81 \| 40 39 s 2H \| 31 31 td 2H J 8 85 \| 26 25 m 3H \| 23 22 ddd 2H J 56 83 152 \| 21 19 m 4H \| 18 17 ddd 2H J 56 83 139	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=CCCCCCCCCOCc1ccccc1	ir: 2 2 0 1 1 1 1 4 1 1 1 2 1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 2 3 4 15 21 2 2 2 3 4 3 3 16 14 9 4 1 4 1 1 1 4 0 1 2 2 1 1 1 1 1 1 1 1 5 3 5 2 2 6 24 18 8 5 3 29 4 3 2 4 1 3 1 1 2 1 1 1 1 1 1 12 9 4 2 2 2 3 2 2 3 1 1 1 1 1 1 5 3 7 4 6 9 5 3 3 4 4 2 2 3 6 14 11 5 6 3 2 2 2 2 5 1 2 2 2 1 5 100 2 13 30 9 1 4 13 37 6 2 3 2 1 1 1 13 2 1 1 1 1 2 2 1 1 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 3 4 10 6 2 3 2 7 19 6 8 24 24 17 24 60 31 14 7 5 7 6 4 1 3 1 1 1 1 1 0 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 73 m 5H \| 59 57 m 1H \| 51 51 dq 1H J 16 102 \| 50 49 ddt 1H J 13 24 172 \| 45 44 m 1H \| 35 35 t 2H J 60 \| 21 20 tdt 2H J 14 68 82 \| 16 15 tt 2H J 60 75 \| 14 12 m 10H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CS(=O)C1(NC(=O)COc2ccccc2)CNC1=O	ir: 2 1 0 1 2 1 1 1 3 2 1 1 6 7 10 5 4 1 1 2 2 2 1 3 3 2 0 3 4 4 4 6 5 21 18 15 4 20 39 78 45 74 54 15 3 8 4 3 4 3 6 2 3 1 1 3 4 3 14 8 8 2 8 1 2 1 4 8 13 4 5 6 3 1 3 3 2 2 12 4 1 1 2 2 1 1 2 2 2 1 2 2 2 17 16 10 5 2 3 2 2 2 2 1 1 1 2 2 2 6 15 2 2 1 6 6 11 6 13 12 4 11 13 10 4 2 3 2 0 2 2 1 1 2 4 9 1 2 3 2 0 3 12 43 25 83 100 82 20 7 4 11 61 54 2 2 2 2 1 8 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 2 1 1 1 1 1 0 1 2 2 3 2 2 1 2 3 2 3 2 4 7 12 8 20 33 10 3 4 2 1 1 1 1 1 1 1 1 1 1 1 1 1 3 4 13 9 14 19 56 58 16 11 4 1 1 1 2 1 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 81 80 s 1H \| 73 73 m 2H \| 71 71 t 1H J 34 \| 70 69 m 3H \| 46 45 m 2H \| 42 41 dd 1H J 33 130 \| 39 39 dd 1H J 33 128 \| 25 25 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN1CCN(c2cc(N3CCc4ccc(-n5cc(Cl)cn5)cc4C3)nc(N)n2)CC1	ir: 3 3 3 2 2 3 2 3 1 1 2 4 10 5 5 3 4 2 3 4 2 2 3 5 1 2 3 2 5 3 4 1 3 3 2 5 13 22 12 11 15 3 11 6 6 7 3 2 2 2 2 2 2 4 9 5 2 2 1 1 4 2 2 11 3 24 11 5 3 2 2 0 1 1 3 3 2 3 13 5 6 3 3 4 8 4 4 3 12 2 3 1 2 8 1 1 9 8 2 3 3 4 5 1 1 1 0 1 1 1 1 1 1 2 1 1 1 3 0 1 4 4 4 4 1 1 2 1 1 2 1 3 2 4 2 2 4 4 4 4 3 4 18 7 10 36 46 42 11 9 4 3 3 2 1 1 2 2 2 3 5 21 9 6 7 2 1 2 1 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 1 1 2 4 4 4 7 13 3 3 3 1 1 1 1 1 1 2 1 1 1 2 2 4 7 24 7 2 2 2 1 1 1 1 1 1 2 100 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 81 81 s 1H \| 80 80 s 1H \| 77 77 dd 1H J 21 83 \| 75 75 dt 1H J 9 21 \| 73 72 dt 1H J 9 84 \| 64 64 s 2H \| 52 51 s 1H \| 49 48 d 2H J 10 \| 40 39 m 2H \| 37 36 m 4H \| 29 29 m 2H \| 29 29 s 3H \| 25 24 m 4H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(O)C#Cc1cc(-c2ccc(C(C)(O)C(F)(F)F)cc2)ccc1S(=O)(=O)c1ccccc1	ir: 8 7 11 11 3 6 8 7 11 14 6 19 16 10 8 8 11 13 4 5 5 9 18 5 3 4 4 4 3 7 5 4 4 6 6 4 3 3 4 10 29 7 5 1 3 3 3 2 6 4 5 7 5 3 21 5 11 9 4 4 7 7 15 6 9 5 3 3 11 12 5 4 3 4 4 4 4 8 5 3 5 23 20 6 95 28 20 12 25 17 6 7 11 15 23 20 24 10 6 8 8 8 2 4 8 6 4 3 18 10 2 6 5 4 3 4 7 5 5 8 17 11 3 7 4 5 4 5 12 5 4 5 4 7 9 8 9 3 2 3 11 9 12 13 5 4 11 30 6 5 5 3 4 4 5 3 3 2 3 3 3 2 2 3 3 3 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 2 2 2 2 3 2 5 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 2 2 2 2 2 2 3 2 2 2 2 2 2 2 3 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 2 3 2 2 2 2 3 4 2 2 2 2 2 3 3 4 3 5 3 8 26 0 18 100 30 14 9 5 5 27 12 12 4 4 3 3 3 3 2 2 3 2 2 2 3 3 2 2 2 2 2 2 3 2 2 2 2 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2; 1HNMR: 82 81 d 1H J 22 \| 81 80 d 1H J 87 \| 79 79 m 2H \| 77 77 dd 1H J 21 87 \| 76 75 m 5H \| 74 74 m 2H \| 37 37 q 1H J 34 \| 27 26 s 1H \| 16 16 m 9H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(COc1ccc(Cl)c(F)c1)OCC	ir: 9 9 9 10 13 12 13 18 23 12 10 13 10 9 9 11 9 9 9 9 9 9 9 9 9 9 11 9 9 9 8 9 9 9 9 9 9 8 8 9 9 8 8 10 9 8 9 10 9 8 11 14 12 12 32 0 18 16 15 10 9 10 10 14 10 18 16 100 31 17 12 11 12 12 16 37 23 18 14 13 29 11 9 9 10 10 9 11 10 9 8 8 10 16 10 11 11 9 9 9 9 9 9 9 9 9 9 10 9 9 9 10 10 13 11 9 10 10 11 10 9 11 9 11 13 11 9 10 17 17 13 9 9 9 9 9 9 8 9 16 9 8 8 9 9 9 10 13 10 13 14 11 18 19 11 9 9 9 9 9 13 17 10 9 9 8 9 9 9 8 9 9 9 8 9 9 9 9 9 9 9 8 9 9 8 8 9 9 9 9 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 9 9 9 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 9 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 9 10 11 9 9 9 10 10 9 10 9 8 9 11 10 11 21 20 23 99 24 7 13 12 9 7 9 10 9 8 9 9 8 8 9 9 9 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 8 8 8 9 8 8 8 9 8 8 8 9 8 8 9 9 8 8 8 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 9 8 8 9 8 8 8 9 8 8 8 9 9 8; 1HNMR: 74 73 dd 1H J 48 99 \| 67 67 dd 1H J 21 99 \| 66 66 dd 1H J 22 121 \| 48 48 t 1H J 27 \| 42 42 d 2H J 26 \| 37 36 dq 2H J 63 114 \| 36 35 dq 2H J 63 113 \| 12 12 t 6H J 63	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
OCCCc1cnoc1-c1ccc(F)cc1F	ir: 3 5 5 6 3 6 16 10 2 5 6 9 9 7 5 2 1 4 13 11 1 5 21 11 3 3 3 1 1 3 5 1 1 3 4 1 7 10 2 0 2 4 4 0 1 4 2 0 2 5 4 1 5 4 23 18 6 14 4 0 4 5 5 3 3 7 8 10 7 6 4 1 3 4 4 2 3 4 3 3 13 9 5 8 6 6 12 14 34 62 26 20 10 13 8 7 5 4 2 2 4 2 2 10 6 3 2 3 7 10 8 5 4 3 3 4 5 5 1 4 3 6 2 5 7 6 7 5 3 2 1 3 5 6 1 2 3 2 1 3 4 7 3 3 3 3 7 11 4 5 8 8 25 10 11 7 3 1 1 3 3 29 13 3 2 0 2 3 2 0 2 3 1 0 2 3 1 1 2 3 1 0 2 3 1 0 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 0 2 3 2 1 2 3 2 0 2 3 1 0 2 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 3 2 2 3 5 2 4 3 2 3 3 2 3 14 11 6 28 100 36 14 3 0 3 5 37 76 10 5 2 1 2 4 2 2 3 3 2 1 3 3 1 1 2 3 2 4 3 3 1 2 3 2 1 1 3 2 1 1 3 2 1 1 3 2 0 1 3 2 0 1 3 1 0 2 3 1 0 2 3 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 3; 1HNMR: 83 83 t 1H J 9 \| 77 76 dt 1H J 50 79 \| 71 70 td 1H J 28 121 \| 70 70 ddd 1H J 27 78 105 \| 36 36 q 2H J 58 \| 34 33 t 1H J 56 \| 29 28 td 2H J 9 106 \| 20 19 tt 2H J 59 106	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)c1ccc(C(=O)N[C@@H](Cc2ccc(-c3ncc(Br)cn3)cc2)C(=O)O)cc1	ir: 0 1 1 1 0 1 1 2 1 1 2 5 1 5 5 8 8 2 1 6 14 15 8 6 6 2 3 2 2 4 2 2 11 3 1 2 1 1 1 1 10 35 3 2 1 1 2 3 1 0 2 67 6 2 2 1 5 1 1 2 1 2 4 0 1 1 1 0 0 2 1 2 1 2 2 2 2 5 2 7 5 1 2 1 3 3 2 5 1 1 1 4 1 1 1 1 1 1 1 1 1 1 1 2 3 1 0 2 2 1 1 1 2 3 1 1 1 1 4 4 8 3 2 5 8 6 3 17 0 3 3 1 1 1 1 1 1 2 2 1 2 4 14 100 16 11 8 2 2 15 6 19 4 1 2 2 4 9 1 1 0 0 1 2 2 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 1 1 0 1 2 1 1 1 4 4 2 13 17 3 4 2 2 1 1 1 1 38 20 4 0 1 1 1 1 1 1 0 0 2 3 4 13 22 11 2 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 97 97 s 1H \| 90 90 s 2H \| 80 79 m 3H \| 78 77 m 2H \| 75 74 m 2H \| 74 73 dq 2H J 9 88 \| 46 45 dt 1H J 68 88 \| 32 31 ddt 1H J 8 68 142 \| 30 29 ddt 1H J 8 68 141 \| 14 13 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(Cn2ncc3c(Cl)ccnc32)cc1	ir: 1 2 2 2 15 13 9 67 20 2 6 3 2 3 7 13 8 6 4 2 2 8 12 5 0 2 1 1 1 1 2 1 4 24 15 3 5 7 19 1 5 23 19 1 2 58 31 12 31 28 3 2 3 9 18 51 13 24 9 1 4 5 4 10 4 4 2 0 2 4 1 2 6 15 10 3 4 5 1 2 6 1 1 0 1 1 5 19 9 5 4 4 3 6 5 2 12 41 65 9 4 3 2 0 2 2 3 9 7 1 0 1 1 1 2 3 4 8 6 4 4 4 6 6 4 9 5 6 2 1 5 5 1 1 0 1 1 0 0 6 8 0 1 5 5 4 4 8 34 16 25 8 30 0 2 65 100 69 7 1 1 6 5 1 1 1 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 2 1 1 2 2 2 1 2 1 1 2 4 3 18 19 13 47 70 31 7 7 3 3 3 3 2 2 1 1 1 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1; 1HNMR: 85 84 d 1H J 27 \| 83 83 s 1H \| 74 73 d 1H J 27 \| 73 72 dp 2H J 9 71 \| 69 69 m 2H \| 56 55 d 2H J 9 \| 38 38 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
S=C=NCc1ccc(Cl)c(Cl)c1	ir: 3 7 10 10 14 7 12 6 12 10 9 6 6 9 8 8 6 7 9 7 6 7 11 7 4 9 5 6 3 7 7 3 7 6 6 5 9 9 9 11 9 6 6 4 6 7 5 2 4 8 8 10 14 10 17 9 9 8 5 2 4 5 3 2 5 7 6 5 7 5 6 2 4 5 3 2 3 5 4 5 9 8 2 2 4 4 2 2 4 6 9 29 12 15 3 5 7 11 4 4 5 4 1 2 5 3 1 3 5 3 1 3 5 3 1 4 6 4 5 5 8 9 7 7 19 11 6 8 7 3 1 4 4 2 1 4 7 14 2 4 4 2 2 4 4 3 7 15 12 5 4 7 11 12 8 5 4 1 2 5 5 1 3 6 3 0 7 27 30 14 41 6 5 3 3 4 3 2 3 4 3 2 3 4 2 2 3 4 2 2 3 4 2 2 3 4 2 2 3 4 2 2 4 3 2 2 4 3 2 2 4 3 2 2 4 3 1 2 4 3 1 3 4 3 1 3 4 3 1 3 4 3 1 3 4 3 1 3 4 2 1 3 4 2 2 3 4 2 2 3 4 2 2 3 4 2 2 3 3 2 2 4 3 2 2 4 3 2 2 4 3 2 3 4 3 2 3 4 3 2 3 6 7 5 10 35 99 40 100 11 7 3 4 5 4 2 5 5 3 2 3 4 2 2 3 4 2 2 3 3 2 2 3 3 2 2 3 3 2 2 4 3 2 2 4 3 2 2 4 3 2 2 4 3 2 3 4 3 2 3 4 3 1 3 4 3 2 3 4 3 2 3 4 2 2 3 4 2 2 3 4 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 4 3 2 2 4 3 2 3 4 3 2 3 4 3 2 3 4; 1HNMR: 74 73 dt 1H J 9 19 \| 73 73 d 1H J 76 \| 71 71 ddt 1H J 9 20 76 \| 48 48 t 2H J 8	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccc(CCCN)cc1C	ir: 2 0 1 1 1 3 3 0 0 1 1 0 1 1 1 1 0 1 1 1 2 2 1 1 0 0 0 0 1 0 1 0 1 1 1 1 1 1 1 2 2 2 5 2 6 3 3 11 8 5 4 3 28 47 13 19 3 5 5 4 3 3 3 0 3 1 2 3 9 6 11 12 30 22 24 9 3 2 2 4 11 17 18 3 5 2 2 1 2 1 0 1 1 3 9 5 2 1 2 4 1 1 0 1 1 1 1 1 3 3 5 2 2 2 1 1 3 2 2 2 4 4 11 5 4 6 3 3 8 4 9 36 53 33 28 27 7 10 2 2 0 2 2 2 1 2 1 0 1 2 4 0 1 1 2 0 1 1 0 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 1 0 1 1 1 1 1 1 2 1 1 2 1 1 2 5 7 3 14 20 20 5 1 1 1 2 1 1 1 4 5 12 25 38 21 22 3 3 5 6 10 100 69 6 2 1 1 1 1 1 5 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 71 70 dq 1H J 9 81 \| 69 68 q 1H J 10 \| 68 68 ddt 1H J 9 20 82 \| 28 27 tt 2H J 54 63 \| 27 26 tt 2H J 9 75 \| 23 23 d 3H J 11 \| 22 22 s 2H \| 19 18 tt 2H J 53 75 \| 12 12 t 2H J 63	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1c(C=CCCOCc2ccccc2)nc2ccccc2c1OCc1ccccc1	ir: 3 7 4 3 2 2 2 3 6 4 5 1 1 1 1 1 1 1 1 1 2 4 2 1 1 2 4 3 4 17 33 36 23 9 2 3 2 13 12 46 53 4 9 55 23 13 2 4 8 7 3 3 2 1 2 5 3 7 1 4 4 4 10 9 9 8 8 20 26 8 8 14 12 15 15 32 17 15 10 4 4 5 10 3 1 0 1 3 9 9 3 5 2 1 2 2 2 5 4 2 1 1 1 1 1 2 1 2 2 1 2 2 7 2 3 2 2 4 4 10 14 6 5 3 3 6 3 7 4 4 17 11 6 4 8 27 8 12 6 2 1 4 17 54 12 30 34 11 36 12 3 7 4 40 6 2 2 21 2 1 1 2 3 12 13 8 2 1 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 1 2 2 5 3 3 3 3 5 6 10 45 34 54 100 38 11 11 7 3 2 2 2 2 1 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 81 81 dd 1H J 14 86 \| 79 78 dd 1H J 14 75 \| 77 76 td 1H J 12 70 \| 74 73 m 12H \| 66 65 dt 1H J 13 148 \| 62 61 dtt 1H J 9 62 148 \| 51 50 d 2H J 10 \| 45 45 t 2H J 8 \| 37 36 td 2H J 9 58 \| 25 24 qd 2H J 13 59 \| 23 23 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

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