| SpectraBase Compound ID | Fa6XXTJH8nf |
|---|---|
| InChI | InChI=1S/C29H44O2/c1-19(2)8-7-9-20(3)25-12-13-26-24-11-10-22-18-23(31-21(4)30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10-11,15,19-20,23,25-26H,7-9,12-14,16-18H2,1-6H3 |
| InChIKey | JUBGEYIHKGKYIM-UHFFFAOYSA-N |
| Mol Weight | 424.7 g/mol |
| Molecular Formula | C29H44O2 |
| Exact Mass | 424.334131 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | C3dbiUrJqUj |
|---|---|
| Name | Cholesta-5,7,9(11)-trien-3-yl acetate |
| CAS Registry Number | 1255-91-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H44O2 |
| InChI | InChI=1S/C29H44O2/c1-19(2)8-7-9-20(3)25-12-13-26-24-11-10-22-18-23(31-21(4)30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10-11,15,19-20,23,25-26H,7-9,12-14,16-18H2,1-6H3 |
| InChIKey | JUBGEYIHKGKYIM-UHFFFAOYSA-N |
| Molecular Weight | 424.669 g/mol |
| SMILES | C1(CCC2(C(C1)=CC=C1C2=CCC2(C1CCC2C(CCCC(C)C)C)C)C)OC(C)=O |
| SPLASH | splash10-0006-9310000000-db59f4994f23b18a8173 |
| Source of Spectrum | NP-14-9400-0 |
| Synonyms | Cholesta-5,7,9(11)-trien-3-ol acetate Acetic acid [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,12,14,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-3-yl] ester [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,12,14,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,12,14,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,12,14,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate |
| Wiley ID | 1112125 |