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Cholest-4-en-3-one
SpectraBase Compound ID 8r0XSUWF1No
InChI InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h17-19,22-25H,6-16H2,1-5H3/t19-,22?,23?,24?,25?,26?,27?/m1/s1
InChIKey NYOXRYYXRWJDKP-ZLJISBBSSA-N
Mol Weight 384.6 g/mol
Molecular Formula C27H44O
Exact Mass 384.339216 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5iMmb2hlo
Name Cholest-4-en-3-one
CAS Registry Number 601-57-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H44O
InChI InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h17-19,22-25H,6-16H2,1-5H3/t19-,22?,23?,24?,25?,26?,27?/m1/s1
InChIKey NYOXRYYXRWJDKP-ZLJISBBSSA-N
Molecular Weight 384.648 g/mol
SMILES C12(C(C3CCC=4C(C3CC2)(CCC(=O)C4)C)CCC1[C@@](CCCC(C)C)(C)[H])C
SPLASH splash10-0230-4944000000-df2846586a206454d4e1
Source of Spectrum SD-1992-0-0
Synonyms .delta.-4-Cholesten-3-one 10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 17-(1,5-dimethylhexyl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 3-Oxocholest-4-ene 4-Cholesten-3-one 4-Cholestenone Cholestenone Delta(sup 4)-cholestenone Delta4-cholesten-3-one EINECS 210-005-1 NSC 134926 NSC 63000
Wiley ID 161057