| SpectraBase Compound ID | 4vx2R8OhwLI |
|---|---|
| InChI | InChI=1S/C26H42O3/c1-6-8-9-10-13-25(3,4)19-15-22(28)24-20-14-18(17-27)11-12-21(20)26(5,7-2)29-23(24)16-19/h15-16,18,20-21,27-28H,6-14,17H2,1-5H3/t18-,20-,21-,26+/m1/s1 |
| InChIKey | XSWSALXKDAAJCQ-STLTWMRASA-N |
| Mol Weight | 402.6 g/mol |
| Molecular Formula | C26H42O3 |
| Exact Mass | 402.313395 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 34UtZrTfAe |
|---|---|
| Name | 12.beta.-Methyl-9-nor-9.beta.-(hydroxymethyl)hexahydrocannabinol |
| Alternate Name(s) | (6S,6aR,9R,10aR)-6-ethyl-9-(hydroxymethyl)-6-methyl-3-(2-methyloctan-2-yl)-6a,7,8,9,10,10a-hexahydrobenzo[c][1]benzopyran-1-ol (6S,6aR,9R,10aR)-3-(1,1-dimethylheptyl)-6-ethyl-9-(hydroxymethyl)-6-methyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-1-ol (6S,6aR,9R,10aR)-6-ethyl-9-(hydroxymethyl)-6-methyl-3-(2-methyloctan-2-yl)-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-1-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H42O3 |
| InChI | InChI=1S/C26H42O3/c1-6-8-9-10-13-25(3,4)19-15-22(28)24-20-14-18(17-27)11-12-21(20)26(5,7-2)29-23(24)16-19/h15-16,18,20-21,27-28H,6-14,17H2,1-5H3/t18-,20-,21-,26+/m1/s1 |
| InChIKey | XSWSALXKDAAJCQ-STLTWMRASA-N |
| Molecular Weight | 402.619 g/mol |
| SMILES | OC[C@@]1(CC[C@@]2([C@](c3c(cc(cc3O[C@]2(CC)C)C(CCCCCC)(C)C)O)(C1)[H])[H])[H] |
| SPLASH | splash10-02u0-7429300000-46f68d7d828da41ba748 |
| Source of Spectrum | F2-41-3605-11 |
| Wiley ID | 1599843 |