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Cholest-4-ene-3,6-dione
SpectraBase Compound ID FNytLLOIYT7
InChI InChI=1S/C27H42O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h15,17-18,20-23H,6-14,16H2,1-5H3
InChIKey GWOSBUGZGFVDDS-UHFFFAOYSA-N
Mol Weight 398.6 g/mol
Molecular Formula C27H42O2
Exact Mass 398.318481 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLG8BEr10sG
Name Cholest-4-ene-3,6-dione
CAS Registry Number 984-84-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H42O2
InChI InChI=1S/C27H42O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h15,17-18,20-23H,6-14,16H2,1-5H3
InChIKey GWOSBUGZGFVDDS-UHFFFAOYSA-N
Molecular Weight 398.631 g/mol
SMILES CC(C)CCCC(C)C1CCC2C1(CCC1C2CC(=O)C2=CC(=O)CCC12C)C
SPLASH splash10-052f-9711000000-7a4d8f9b975393deb171
Source of Spectrum V-6-3-3
Synonyms .delta.(Sup4)-Cholestene-3,6-dione .delta.4-Cholestene-3,6-dione 10,13-dimethyl-17-(6-methylheptan-2-yl)-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,6-dione 17-(1,5-dimethylhexyl)-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,6-dione 17-(1,5-dimethylhexyl)-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,6-quinone 4-Cholestene-3,6-dione Cholest-4-en-3,6-dione
Wiley ID 56974