| SpectraBase Compound ID | 9Kynk0ZSRtr |
|---|---|
| InChI | InChI=1S/C27H44O4/c1-5-6-7-8-12-26(2,3)20-16-23(30)25-21-15-19(18-29)10-11-22(21)27(4,13-9-14-28)31-24(25)17-20/h16-17,19,21-22,28-30H,5-15,18H2,1-4H3/t19-,21-,22-,27+/m1/s1 |
| InChIKey | PHILDZBONNKMNU-UOTIDGTBSA-N |
| Mol Weight | 432.6 g/mol |
| Molecular Formula | C27H44O4 |
| Exact Mass | 432.32396 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DH2tizzphgC |
|---|---|
| Name | 12.beta.-(2-Hydroxyethyl)-9-nor-9-.beta.-(hydroxymethyl)hexahydrocannabinol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H44O4 |
| InChI | InChI=1S/C27H44O4/c1-5-6-7-8-12-26(2,3)20-16-23(30)25-21-15-19(18-29)10-11-22(21)27(4,13-9-14-28)31-24(25)17-20/h16-17,19,21-22,28-30H,5-15,18H2,1-4H3/t19-,21-,22-,27+/m1/s1 |
| InChIKey | PHILDZBONNKMNU-UOTIDGTBSA-N |
| Molecular Weight | 432.645 g/mol |
| SMILES | OC[C@@]1(CC[C@@]2([C@](c3c(cc(cc3O[C@]2(CCCO)C)C(CCCCCC)(C)C)O)(C1)[H])[H])[H] |
| SPLASH | splash10-0002-0459400000-6ff402055b6f74344708 |
| Source of Spectrum | F2-41-3607-7 |
| Synonyms | (6S,6aR,9R,10aR)-9-(hydroxymethyl)-6-(3-hydroxypropyl)-6-methyl-3-(2-methyloctan-2-yl)-6a,7,8,9,10,10a-hexahydrobenzo[c][1]benzopyran-1-ol (6S,6aR,9R,10aR)-9-(hydroxymethyl)-6-(3-hydroxypropyl)-6-methyl-3-(2-methyloctan-2-yl)-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-1-ol (6S,6aR,9R,10aR)-3-(1,1-dimethylheptyl)-9-(hydroxymethyl)-6-(3-hydroxypropyl)-6-methyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-1-ol (6S,6aR,9R,10aR)-9-(hydroxymethyl)-6-methyl-3-(2-methyloctan-2-yl)-6-(3-oxidanylpropyl)-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-1-ol |
| Wiley ID | 1599835 |