| SpectraBase Compound ID | 3jZiIlFjSln |
|---|---|
| InChI | InChI=1S/C20H30O2/c1-12(2)14-8-9-20(5)17(22)11-19(4)10-16(21)13(3)6-7-15(19)18(14)20/h8,12,15-16,18,21H,3,6-7,9-11H2,1-2,4-5H3/t15-,16-,18-,19-,20+/m0/s1 |
| InChIKey | YBQUCTGYBPMQDP-CZKCSJLSSA-N |
| Mol Weight | 302.46 g/mol |
| Molecular Formula | C20H30O2 |
| Exact Mass | 302.22458 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DxmzEFhd8T5 |
|---|---|
| Name | Isoepipolone |
| Alternate Name(s) | (3aS,5aS,7S,10aS,10bR)-7-hydroxy-3a,5a-dimethyl-8-methylene-1-propan-2-yl-3,5,6,7,9,10,10a,10b-octahydrocyclohepta[e]inden-4-one (3aS,5aS,7S,10aS,10bR)-7-hydroxy-3a,5a-dimethyl-8-methylidene-1-propan-2-yl-3,5,6,7,9,10,10a,10b-octahydrocyclohepta[e]inden-4-one (3aS,5aS,7S,10aS,10bR)-7-hydroxy-1-isopropyl-3a,5a-dimethyl-8-methylene-3,5,6,7,9,10,10a,10b-octahydrocyclohepta[e]inden-4-one (3aS,5aS,7S,10aS,10bR)-3a,5a-dimethyl-8-methylidene-7-oxidanyl-1-propan-2-yl-3,5,6,7,9,10,10a,10b-octahydrocyclohepta[e]inden-4-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H30O2 |
| InChI | InChI=1S/C20H30O2/c1-12(2)14-8-9-20(5)17(22)11-19(4)10-16(21)13(3)6-7-15(19)18(14)20/h8,12,15-16,18,21H,3,6-7,9-11H2,1-2,4-5H3/t15-,16-,18-,19-,20+/m0/s1 |
| InChIKey | YBQUCTGYBPMQDP-CZKCSJLSSA-N |
| Molecular Weight | 302.458 g/mol |
| SMILES | O[C@]1(C[C@@]2([C@]([C@]3([C@@](C(=O)C2)(CC=C3C(C)C)C)[H])(CCC1=C)[H])C)[H] |
| SPLASH | splash10-0avl-5930000000-7389023da163041dae32 |
| Source of Spectrum | J-66-6368-2 |
| Wiley ID | 1535924 |