| SpectraBase Compound ID | 9gyKmkIL6eV |
|---|---|
| InChI | InChI=1S/C22H32O3/c1-14(2)15-8-9-17-16(12-15)18(24-5)13-19-21(17,3)10-7-11-22(19,4)20(23)25-6/h8-9,12,14,18-19H,7,10-11,13H2,1-6H3/t18-,19?,21-,22-/m1/s1 |
| InChIKey | CDJVFESJEAWQGP-BAWFOZSCSA-N |
| Mol Weight | 344.5 g/mol |
| Molecular Formula | C22H32O3 |
| Exact Mass | 344.235145 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JVpzPKumZe |
|---|---|
| Name | Methyl 7-.alpha.-methoxy-dehydroabietate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H32O3 |
| InChI | InChI=1S/C22H32O3/c1-14(2)15-8-9-17-16(12-15)18(24-5)13-19-21(17,3)10-7-11-22(19,4)20(23)25-6/h8-9,12,14,18-19H,7,10-11,13H2,1-6H3/t18-,19?,21-,22-/m1/s1 |
| InChIKey | CDJVFESJEAWQGP-BAWFOZSCSA-N |
| Molecular Weight | 344.495 g/mol |
| SMILES | C12[C@@](c3ccc(cc3[C@@](C2)(OC)[H])C(C)C)(CCC[C@]1(C(=O)OC)C)C |
| SPLASH | splash10-000i-0593000000-d635e2940280e9eaf355 |
| Source of Spectrum | OP-25-220-8 |
| Synonyms | (1R,4aS,9R)-9-methoxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid methyl ester Methyl (1R,4aS,9R)-7-isopropyl-9-methoxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate Methyl (1R,4aS,9R)-9-methoxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate |
| Wiley ID | 850522 |