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Cholest-5-en-3-ol (3-beta) propanoate
SpectraBase Compound ID BZlcRFDa87c
InChI InChI=1S/C30H50O2/c1-7-28(31)32-23-15-17-29(5)22(19-23)11-12-24-26-14-13-25(21(4)10-8-9-20(2)3)30(26,6)18-16-27(24)29/h11,20-21,23-27H,7-10,12-19H2,1-6H3
InChIKey CCORPVHYPHHRKB-UHFFFAOYSA-N
Mol Weight 442.7 g/mol
Molecular Formula C30H50O2
Exact Mass 442.381081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IaUEzFtdozp
Name Cholest-5-en-3-ol (3.beta.)-, propanoate
Alternate Name(s) Cholest-5-en-3-yl propionate Cholest-5-en-3-ol (3beta)-, propanoate Cholesterol n-propionate Cholesterol, propionate Cholesteryl n-propionate Cholesteryl propionate Propionyloxy-3.beta. cholestene-5 Propionyloxy-3beta cholestene-5 Propanoic 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] propanoate [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] propanoate EINECS 211-191-7 NSC 226871
CAS Registry Number 633-31-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O2
InChI InChI=1S/C30H50O2/c1-7-28(31)32-23-15-17-29(5)22(19-23)11-12-24-26-14-13-25(21(4)10-8-9-20(2)3)30(26,6)18-16-27(24)29/h11,20-21,23-27H,7-10,12-19H2,1-6H3
InChIKey CCORPVHYPHHRKB-UHFFFAOYSA-N
Molecular Weight 442.728 g/mol
SMILES CC12C3C(C4C(C)(C(C(CCCC(C)C)C)CC4)CC3)CC=C1CC(OC(CC)=O)CC2
SPLASH splash10-0a4m-8911000000-6fc430d20cd739649c51
Source of Spectrum W5-35283-30253-30253
Wiley ID 1385536