| SpectraBase Compound ID | 1qgyI09JhMt |
|---|---|
| InChI | InChI=1S/C20H30O3/c1-18(2)15-7-6-13-12-19(3,17(22)23-5)10-8-14(13)20(15,4)11-9-16(18)21/h6,14-15H,7-12H2,1-5H3 |
| InChIKey | MMBPQEHAVVKHAX-UHFFFAOYSA-N |
| Mol Weight | 318.46 g/mol |
| Molecular Formula | C20H30O3 |
| Exact Mass | 318.219495 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7fpOURdRdDW |
|---|---|
| Name | 2-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,8,8a,9-dodecahydro-2,4b,8,8-tetramethyl-7-oxo-, methyl ester |
| CAS Registry Number | 57397-05-4 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H30O3 |
| InChI | InChI=1S/C20H30O3/c1-18(2)15-7-6-13-12-19(3,17(22)23-5)10-8-14(13)20(15,4)11-9-16(18)21/h6,14-15H,7-12H2,1-5H3 |
| InChIKey | MMBPQEHAVVKHAX-UHFFFAOYSA-N |
| Molecular Weight | 318.457 g/mol |
| SMILES | CC12C3C(CC(CC3)(C(OC)=O)C)=CCC1C(C)(C)C(CC2)=O |
| SPLASH | splash10-0a4i-4930000000-80605c94a4be1b7b5d6e |
| Source of Spectrum | EP-7962-0-0 |
| Synonyms | Methyl 13-methyl-3-oxopodocarp-7-ene-13-carboxylate 2,4b,8,8-tetramethyl-7-oxo-1,3,4,4a,5,6,8a,9-octahydrophenanthrene-2-carboxylic acid methyl ester 7-keto-2,4b,8,8-tetramethyl-1,3,4,4a,5,6,8a,9-octahydrophenanthrene-2-carboxylic acid methyl ester Methyl 2,4b,8,8-tetramethyl-7-oxidanylidene-1,3,4,4a,5,6,8a,9-octahydrophenanthrene-2-carboxylate Methyl 2,4b,8,8-tetramethyl-7-oxo-1,3,4,4a,5,6,8a,9-octahydrophenanthrene-2-carboxylate |
| Wiley ID | 1318760 |