cmpdname
stringlengths 27
27
| mf
stringlengths 2
24
|
|---|---|
2-Methylheptadecyl benzoate | C25H42O2 |
Chloro-decyl-propoxyalumane | C13H28AlClO |
(Z)-2-azido-1-phenylethenol | C8H7N3O |
Cer 20:0;2O/12:1;O(FA 20:2) | C52H97NO5 |
Guanidinium 4-aminobenzoate | C8H12N4O2 |
6-Methyloct-6-ene-2,5-dione | C9H14O2 |
6-iodo-5H-benzo[b]carbazole | C16H10IN |
Cer 21:1;2O/38:2;O(FA 22:0) | C81H155NO5 |
Cer 15:1;2O/17:0;O(FA 18:2) | C50H93NO5 |
1-Azidobicyclo[2.2.2]octane | C8H13N3 |
2,6-Dinitrocyclohexan-1-one | C6H8N2O5 |
Cer 23:0;2O/36:1;O(FA 15:0) | C74H145NO5 |
L-Alanyl-O-benzoyl-L-serine | C13H16N2O5 |
Gallium--praseodymium (1/1) | GaH3Pr |
Cer 22:1;2O/30:0;O(FA 19:2) | C71H135NO5 |
Chloromethyl(methoxy)silane | C2H7ClOSi |
Sulfonamidopyrrolidinone 3f | C23H23N5O3S |
Bis(2-methylbenzyl cyanide) | C18H18N2 |
Cer 16:1;2O/20:2;O(FA 21:1) | C57H105NO5 |
Methane;2-methylpropan-1-ol | C7H22O |
Phenylsulfamic acid;toluene | C13H15NO3S |
Cer 28:0;2O/13:1;O(FA 16:0) | C57H111NO5 |
3-(4-Nitrophenyl)but-3-enal | C10H9NO3 |
(Dioctylphosphoryl)methanol | C17H37O2P |
2-methoxy(O-2H)benzoic acid | C8H8O3 |
1H-imidazol-1-ium;dibromide | C24H40Br2N16+6 |
N-hexylpyrene-1-carboxamide | C23H23NO |
Copper;octadecanedioic acid | C18H34CuO4 |
6,6-Dimethylhept-2-en-4-yne | C9H14 |
Ethyl 2-bromododec-9-enoate | C14H25BrO2 |
DL-Erythritol 1,4-dinitrate | C4H8N2O8 |
4-ethyl-7H-benzo[7]annulene | C13H14 |
Cer 28:0;2O/27:0;O(FA 16:2) | C71H137NO5 |
Heptadecanoic acid;chloride | C17H34ClO2- |
5-diazonio-2H-pyran-6-olate | C5H4N2O2 |
Cer 23:0;2O/15:0;O(FA 18:0) | C56H111NO5 |
Cer 20:1;2O/27:1;O(FA 16:2) | C63H117NO5 |
(Hexadecylamino)methanediol | C17H37NO2 |
Diphenyl 2-oxopropanedioate | C15H10O5 |
Cer 28:1;2O/16:0;O(FA 21:0) | C65H127NO5 |
Dipropoxyalumanyl butanoate | C10H21AlO4 |
1-(Pyridin-2-yl)propan-1-ol | C8H11NO |
PA(8:0/18:2(10E,12Z)+=O(9)) | C29H51O9P |
Aplysiatoxin 19,21-dibromo- | C32H45Br3O10 |
Cer 23:0;2O/19:0;O(FA 16:0) | C58H115NO5 |
7-Hydroxyoct-7-enoylglycine | C10H17NO4 |
Cer 18:1;2O/30:1;O(FA 16:0) | C64H123NO5 |
Cer 15:0;2O/42:2;O(FA 21:1) | C78H149NO5 |
Ditridecyldimonium chloride | C28H60ClN |
p-Nitrophenyl myristic acid | C20H31NO4 |
1-Hydroxy-1-norresistomycin | C21H14O7 |
2-(Methoxymethylidene)oxane | C7H12O2 |
4-Isopropoxypicolinonitrile | C9H10N2O |
Sodium;triphenylphosphanium | C18H16NaP+2 |
3-(3-Tert-butylphenyl)oxane | C15H22O |
Cer 29:0;2O/22:2;O(FA 22:1) | C73H139NO5 |
Aminoteropterin sodium salt | C29H34N10NaO11+ |
N-trifluoroacetyl-isovaline | C7H10F3NO3 |
Ac4PIM2 16:1_16:1_19:0_18:1 | C90H163O25P |
(7R)-7-hydroxyundecan-5-one | C11H22O2 |
Cer 14:1;2O/16:0;O(FA 20:2) | C50H93NO5 |
2-Aminopyrene-4-carboxamide | C17H12N2O |
(3R,5S)-5-methyloxolan-3-ol | C5H10O2 |
Sodium;tin(4+);hexafluoride | F6NaSn- |
Bromo 5,5-dibromopentanoate | C5H7Br3O2 |
Cer 17:1;2O/38:0;O(FA 20:2) | C75H143NO5 |
2-(6H-indol-7-yl)ethanamine | C10H12N2 |
N-(3-oxooxan-4-yl)formamide | C6H9NO3 |
2-Bromo-2-ethyl-1,3-dioxane | C6H11BrO2 |
Cer 22:0;2O/20:0;O(FA 21:0) | C63H125NO5 |
Cesium;acetate;tetrahydrate | C2H11CsO6 |
2-Bromosulfonylbenzoic acid | C7H5BrO4S |
1-Indol-1-yloctadecan-1-one | C26H41NO |
Cer 30:0;2O/28:1;O(FA 16:0) | C74H145NO5 |
US10807988, Example SC_3155 | C23H25FN4O |
2-Methylcinnamoylpiperazine | C14H18N2O |
Cer 24:1;2O/38:2;O(FA 20:2) | C82H153NO5 |
Cer 18:1;2O/16:1;O(FA 17:1) | C51H95NO5 |
1-Nitro-4-triacontylbenzene | C36H65NO2 |
Disodium;3-sulfinobutanoate | C4H7Na2O4S+ |
H-DL-Tyr-DL-xiThr-DL-Cys-OH | C16H23N3O6S |
Cer 30:1;2O/36:2;O(FA 22:0) | C88H169NO5 |
7-Butyl-9-pentylpentadecane | C24H50 |
4-Ethoxypiperidine;chloride | C7H15ClNO- |
Ethane;ethylbenzene;methane | C11H20 |
TG(i-21:0/20:0/a-21:0)[rac] | C65H126O6 |
O-benzhydryl propanethioate | C16H16OS |
3-chloro-2-phenyl-1H-indole | C14H10ClN |
Cer 26:1;2O/13:0;O(FA 18:1) | C57H109NO5 |
Sodium-potassium bitartrate | C8H10KNaO12 |
Hydroxyphenyl mandelic acid | C14H12O4 |
phenylpropanol-Hydrochlorid | C9H13ClO |
2-Aminoimidazolecarboxamide | C4H6N4O |
Cer 28:0;2O/25:1;O(FA 22:0) | C75H147NO5 |
2-Ethoxyethanol;nitric acid | C4H12N2O8 |
Cer 30:0;2O/40:2;O(FA 17:0) | C87H169NO5 |
Menthyl 2-phosphinylacetate | C12H21O3P |
Cer 16:1;2O/24:0;O(FA 18:1) | C58H111NO5 |
Cer 18:1;2O/33:1;O(FA 18:1) | C69H131NO5 |
Cer 23:1;2O/30:2;O(FA 22:1) | C75H141NO5 |
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