| SpectraBase Compound ID | HYaUf3xbjBI |
|---|---|
| InChI | InChI=1S/C21H34O3/c1-13-14(22)12-16-20(4)10-7-9-19(2,3)15(20)8-11-21(16,5)17(13)18(23)24-6/h14-17,22H,1,7-12H2,2-6H3/t14-,15-,16+,17-,20-,21+/m0/s1 |
| InChIKey | RQJAKXWCURKZLQ-URFAJVILSA-N |
| Mol Weight | 334.5 g/mol |
| Molecular Formula | C21H34O3 |
| Exact Mass | 334.250795 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 30Yiv7PSuUA |
|---|---|
| Name | (1S,3S,4aR,4bS,8aS,10aR)-3-hydroxy-4b,8,8,10a-tetramethyl-2-methylene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthrene-1-carboxylic acid methyl ester |
| CAS Registry Number | 82570-43-2 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H34O3 |
| InChI | InChI=1S/C21H34O3/c1-13-14(22)12-16-20(4)10-7-9-19(2,3)15(20)8-11-21(16,5)17(13)18(23)24-6/h14-17,22H,1,7-12H2,2-6H3/t14-,15-,16+,17-,20-,21+/m0/s1 |
| InChIKey | RQJAKXWCURKZLQ-URFAJVILSA-N |
| Molecular Weight | 334.500 g/mol |
| SMILES | O[C@@]1(C([C@]([C@]2([C@@]([C@]3(CCCC([C@@]3(CC2)[H])(C)C)C)(C1)[H])C)(C(=O)OC)[H])=C)[H] |
| SPLASH | splash10-000f-0901000000-f214145b255ce4f4e79d |
| Source of Spectrum | KC-1983-137-0 |
| Synonyms | Methyl (1S,3S,4aR,4bS,8aS,10aR)-3-hydroxy-4b,8,8,10a-tetramethyl-2-methylene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthrene-1-carboxylate Methyl (1S,3S,4aR,4bS,8aS,10aR)-3-hydroxy-4b,8,8,10a-tetramethyl-2-methylidene-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthrene-1-carboxylate Methyl (1S,3S,4aR,4bS,8aS,10aR)-4b,8,8,10a-tetramethyl-2-methylidene-3-oxidanyl-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthrene-1-carboxylate |
| Wiley ID | 1331311 |