| SpectraBase Compound ID | 2Tmc4pqAsUP |
|---|---|
| InChI | InChI=1S/C20H32O/c1-13(2)15-8-11-20(5)16(15)9-10-19(4)12-17(21)14(3)6-7-18(19)20/h15-18,21H,1,3,6-12H2,2,4-5H3/t15-,16+,17-,18+,19+,20+/m0/s1 |
| InChIKey | GCMRRPGBCMUUSN-XYWBXWKWSA-N |
| Mol Weight | 288.5 g/mol |
| Molecular Formula | C20H32O |
| Exact Mass | 288.245316 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5iYimuinIPO |
|---|---|
| Name | (2S,5aR,5bR,8R,8aR,10aR)-2,3-Dihydro-3-methylenevalparene-2-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H32O |
| InChI | InChI=1S/C20H32O/c1-13(2)15-8-11-20(5)16(15)9-10-19(4)12-17(21)14(3)6-7-18(19)20/h15-18,21H,1,3,6-12H2,2,4-5H3/t15-,16+,17-,18+,19+,20+/m0/s1 |
| InChIKey | GCMRRPGBCMUUSN-XYWBXWKWSA-N |
| Molecular Weight | 288.475 g/mol |
| SMILES | O[C@]1(C[C@@]2([C@]([C@]3([C@@]([C@](C(=C)C)(CC3)[H])(CC2)[H])C)(CCC1=C)[H])C)[H] |
| SPLASH | splash10-0a6u-9600000000-cec79fe0202ec1876da6 |
| Source of Spectrum | AT-31-5668-5 |
| Synonyms | (3R,3aR,5aR,7S,10aR,10bR)-3-isopropenyl-5a,10b-dimethyl-8-methylenetetradecahydrocyclohepta[e]inden-7-ol 2,3-Dihydro-3-methylenevalparene-2-ol (3R,3aR,5aR,7S,10aR,10bR)-5a,10b-dimethyl-8-methylene-3-(1-methylethenyl)-2,3,3a,4,5,6,7,9,10,10a-decahydro-1H-cyclohepta[e]inden-7-ol (3R,3aR,5aR,7S,10aR,10bR)-3-isopropenyl-5a,10b-dimethyl-8-methylene-2,3,3a,4,5,6,7,9,10,10a-decahydro-1H-cyclohepta[e]inden-7-ol (3R,3aR,5aR,7S,10aR,10bR)-5a,10b-dimethyl-8-methylidene-3-prop-1-en-2-yl-2,3,3a,4,5,6,7,9,10,10a-decahydro-1H-cyclohepta[e]inden-7-ol |
| Wiley ID | 835861 |