| SpectraBase Compound ID | KUIXzDZh0lY |
|---|---|
| InChI | InChI=1S/C31H48O3/c1-19-11-16-31(26(33)34-8)18-17-29(6)21(25(31)20(19)2)9-10-23-28(5)14-13-24(32)27(3,4)22(28)12-15-30(23,29)7/h9,19-20,22-23,25H,10-18H2,1-8H3 |
| InChIKey | OGCQKMJALQHROV-UHFFFAOYSA-N |
| Mol Weight | 468.7 g/mol |
| Molecular Formula | C31H48O3 |
| Exact Mass | 468.360345 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5h0IneEAXTR |
|---|---|
| Name | 1,2,6a,6b,9,9,12a-Heptamethyl-10-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-eicoshydropicene-4a-carboxylic acid, methyl ester |
| Alternate Name(s) | Methyl 3-oxours-12-en-28-oate 1,2,6a,6b,9,9,12a-heptamethyl-10-oxo-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid methyl ester 10-keto-1,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid methyl ester Methyl 1,2,6a,6b,9,9,12a-heptamethyl-10-oxidanylidene-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-4a-carboxylate Methyl 1,2,6a,6b,9,9,12a-heptamethyl-10-oxo-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-4a-carboxylate |
| CAS Registry Number | 989-72-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H48O3 |
| InChI | InChI=1S/C31H48O3/c1-19-11-16-31(26(33)34-8)18-17-29(6)21(25(31)20(19)2)9-10-23-28(5)14-13-24(32)27(3,4)22(28)12-15-30(23,29)7/h9,19-20,22-23,25H,10-18H2,1-8H3 |
| InChIKey | OGCQKMJALQHROV-UHFFFAOYSA-N |
| Molecular Weight | 468.722 g/mol |
| SMILES | CC1(C(CCC2(C3CC=C4C(C3(CCC12)C)(CCC1(CCC(C(C)C41)C)C(=O)OC)C)C)=O)C |
| SPLASH | splash10-0ik9-7960100000-2332c1b2a3409922a288 |
| Wiley ID | 1480514 |