| SpectraBase Compound ID | 2MxIK7ekTte |
|---|---|
| InChI | InChI=1S/C20H32O3/c1-13(2)20(23)9-6-15-14(11-20)16(22)10-17-18(3,12-21)7-5-8-19(15,17)4/h11,13,15,17,21,23H,5-10,12H2,1-4H3/t15-,17-,18-,19+,20+/m0/s1 |
| InChIKey | PMKRDHYIJLQVRT-AEEMCCEDSA-N |
| Mol Weight | 320.5 g/mol |
| Molecular Formula | C20H32O3 |
| Exact Mass | 320.235145 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | D1pyVpb8NgR |
|---|---|
| Name | 13.beta.,15-Dihydroxyabiet-8(14)-en-7-one |
| Alternate Name(s) | (1R,4aS,4bR,7S,10aR)-1-(hydroxymethyl)-1,4a-dimethyl-7-oxidanyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthren-9-one (1R,4aS,4bR,7S,10aR)-7-Hydroxy-1-hydroxymethyl-7-isopropyl-1,4a-dimethyl-2,3,4,4a,4b,5,6,7,10,10a-decahydro-1H-phenanthren-9-one (1R,4aS,4bR,7S,10aR)-7-hydroxy-1-(hydroxymethyl)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthren-9-one 13,15-dihydroxyabiet-8(14)-en-7-one (1R,4aS,4bR,7S,10aR)-7-hydroxy-1-(hydroxymethyl)-7-isopropyl-1,4a-dimethyl-2,3,4,4b,5,6,10,10a-octahydrophenanthren-9-one (1R,4aS,4bR,7S,10aR)-7-hydroxy-7-isopropyl-1,4a-dimethyl-1-methylol-2,3,4,4b,5,6,10,10a-octahydrophenanthren-9-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H32O3 |
| InChI | InChI=1S/C20H32O3/c1-13(2)20(23)9-6-15-14(11-20)16(22)10-17-18(3,12-21)7-5-8-19(15,17)4/h11,13,15,17,21,23H,5-10,12H2,1-4H3/t15-,17-,18-,19+,20+/m0/s1 |
| InChIKey | PMKRDHYIJLQVRT-AEEMCCEDSA-N |
| Molecular Weight | 320.473 g/mol |
| SMILES | OC[C@@]1(CCC[C@@]2([C@@]3(C(=C[C@](CC3)(C(C)C)O)C(C[C@@]12[H])=O)[H])C)C |
| SPLASH | splash10-00di-0219000000-6e8e5b393e2929d80114 |
| Source of Spectrum | I-78-39-4 |
| Wiley ID | 812676 |