| SpectraBase Compound ID | EOM9B4aTd9i |
|---|---|
| InChI | InChI=1S/C18H26O3/c1-17-9-4-10-18(2,16(20)21-3)15(17)8-5-12-11-13(19)6-7-14(12)17/h11,14-15H,4-10H2,1-3H3/t14-,15+,17+,18+/m0/s1 |
| InChIKey | ZSISCNCQVRABBK-BURFUSLBSA-N |
| Mol Weight | 290.4 g/mol |
| Molecular Formula | C18H26O3 |
| Exact Mass | 290.188195 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | A2zlBHIwRct |
|---|---|
| Name | (1R,4aR,4bS,10aR)-1,4a-dimethyl-7-oxo-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester |
| CAS Registry Number | 20085-81-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H26O3 |
| InChI | InChI=1S/C18H26O3/c1-17-9-4-10-18(2,16(20)21-3)15(17)8-5-12-11-13(19)6-7-14(12)17/h11,14-15H,4-10H2,1-3H3/t14-,15+,17+,18+/m0/s1 |
| InChIKey | ZSISCNCQVRABBK-BURFUSLBSA-N |
| Molecular Weight | 290.403 g/mol |
| SMILES | [C@@]12([C@]([C@@](C(=O)OC)(C)CCC2)(CCC=2[C@@]1(CCC(=O)C2)[H])[H])C |
| SPLASH | splash10-03k9-0910000000-e61ca66d60b9ef5d60b9 |
| Source of Spectrum | B-43-878-15 |
| Synonyms | (1R,4aR,4bS,10aR)-7-keto-1,4a-dimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester Methyl (1R,4aR,4bS,10aR)-1,4a-dimethyl-7-oxidanylidene-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate Methyl (1R,4aR,4bS,10aR)-1,4a-dimethyl-7-oxo-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate |
| Wiley ID | 1293900 |