| SpectraBase Compound ID | JXw8iTA1okI |
|---|---|
| InChI | InChI=1S/C34H50O2/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-26-22-27(36-32(35)25-12-7-6-8-13-25)18-20-33(26,4)31(28)19-21-34(29,30)5/h6-8,12-14,23-24,27-31H,9-11,15-22H2,1-5H3 |
| InChIKey | UVZUFUGNHDDLRQ-UHFFFAOYSA-N |
| Mol Weight | 490.8 g/mol |
| Molecular Formula | C34H50O2 |
| Exact Mass | 490.381081 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CBDi5yUfJqG |
|---|---|
| Name | Cholesterol benzoate |
| CAS Registry Number | 604-32-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H50O2 |
| InChI | InChI=1S/C34H50O2/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-26-22-27(36-32(35)25-12-7-6-8-13-25)18-20-33(26,4)31(28)19-21-34(29,30)5/h6-8,12-14,23-24,27-31H,9-11,15-22H2,1-5H3 |
| InChIKey | UVZUFUGNHDDLRQ-UHFFFAOYSA-N |
| Molecular Weight | 490.772 g/mol |
| SMILES | C1(CCC2(C(C1)=CCC1C2CCC2(C1CCC2C(CCCC(C)C)C)C)C)OC(=O)c1ccccc1 |
| SPLASH | splash10-052f-9711000000-4a75c90eb2119ea1504b |
| Synonyms | 5-Cholesten-3.beta.-ol benzoate Cholest-5-en-3-ol (3.beta.)-, benzoate Cholest-5-en-3-yl benzoate Cholesteryl benzoate benzoic acid [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] benzoate [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] benzoate |
| Wiley ID | 1472643 |