| SpectraBase Compound ID | 54JhZeEbGya |
|---|---|
| InChI | InChI=1S/C20H30O2/c1-12(2)14-11-13-7-8-15-19(3,4)9-6-10-20(15,5)16(13)18(22)17(14)21/h11-12,15,21-22H,6-10H2,1-5H3/t15-,20-/m0/s1 |
| InChIKey | MUVSVZOWXAYLSD-YWZLYKJASA-N |
| Mol Weight | 302.46 g/mol |
| Molecular Formula | C20H30O2 |
| Exact Mass | 302.22458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JUAS0Y3xLHA |
|---|---|
| Name | Abieta-8,11,13-triene-11,12-diol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.224580204 u |
| Formula | C20H30O2 |
| InChI | InChI=1S/C20H30O2/c1-12(2)14-11-13-7-8-15-19(3,4)9-6-10-20(15,5)16(13)18(22)17(14)21/h11-12,15,21-22H,6-10H2,1-5H3/t15-,20-/m0/s1 |
| InChIKey | MUVSVZOWXAYLSD-YWZLYKJASA-N |
| SMILES | [C@]12(C=3C(=C(O)C(=CC3CC[C@]1(C(C)(C)CCC2)[H])C(C)C)O)C |