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CHOLEST-5-EN-3-OL, ACETATE
SpectraBase Compound ID 8Yu7T9kjm5p
InChI InChI=1S/C29H48O2/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/h10,19-20,23-27H,7-9,11-18H2,1-6H3
InChIKey XUGISPSHIFXEHZ-UHFFFAOYSA-N
Mol Weight 428.7 g/mol
Molecular Formula C29H48O2
Exact Mass 428.365431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3s0RGFHE6i
Name Cholest-5-en-3-ol (3.beta.)-, acetate
Alternate Name(s) Cholest-5-en-3-yl acetate (-)Cholesteryl acetate 3.beta.-Acetoxycholest-5-ene 3a-Cholesterol acetate 5-Cholesten-3.beta.-ol acetate Cholest-5-en-3-ol (3beta)-, acetate Cholest-5-en-3.beta.-ol acetate Cholest-5-en-3.beta.-yl acetate Cholestan-5-en-3-ol acetate Cholesterin acetate Cholesterol, acetate Acetic 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 [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] acetate [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] acetate [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] ethanoate AI3-24120 CCRIS 5350 EINECS 210-066-4 NSC 8799
CAS Registry Number 604-35-3
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Formula C29H48O2
InChI InChI=1S/C29H48O2/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/h10,19-20,23-27H,7-9,11-18H2,1-6H3
InChIKey XUGISPSHIFXEHZ-UHFFFAOYSA-N
Molecular Weight 428.701 g/mol
SMILES CC12C3C(C4C(C)(C(C(CCCC(C)C)C)CC4)CC3)CC=C1CC(OC(C)=O)CC2
SPLASH splash10-014i-6839020000-2b14fd2b5ccbbe503917
Source of Spectrum SD-1992-0-0
Wiley ID 1380918