| SpectraBase Compound ID | BjrqC5cdIHe |
|---|---|
| InChI | InChI=1S/C27H46O/c1-18(2)9-8-10-19(3)21-12-13-22-25-23(14-16-27(21,22)5)26(4)15-7-6-11-20(26)17-24(25)28/h18-23,25H,6-17H2,1-5H3 |
| InChIKey | SFRHQVIYMXPVMD-UHFFFAOYSA-N |
| Mol Weight | 386.7 g/mol |
| Molecular Formula | C27H46O |
| Exact Mass | 386.354866 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IpZhW3WEeQL |
|---|---|
| Name | Cholestan-7-one, (5.alpha.)- |
| CAS Registry Number | 40072-53-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H46O |
| InChI | InChI=1S/C27H46O/c1-18(2)9-8-10-19(3)21-12-13-22-25-23(14-16-27(21,22)5)26(4)15-7-6-11-20(26)17-24(25)28/h18-23,25H,6-17H2,1-5H3 |
| InChIKey | SFRHQVIYMXPVMD-UHFFFAOYSA-N |
| Molecular Weight | 386.664 g/mol |
| SMILES | C12(C(CCCC2)CC(C2C1CCC1(C)C2CCC1C(C)CCCC(C)C)=O)C |
| SPLASH | splash10-000f-6922000000-a78c65b7e3f8347148e8 |
| Source of Spectrum | SD-1981-0-0 |
| Synonyms | 10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-7-one Cholestan-7-one 17-(1,5-dimethylhexyl)-10,13-dimethyl-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-7-one Cholestan-7-one, (5.alpha.,14.beta.)- 7-Cholestanone |
| Wiley ID | 1363164 |