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2-Cholestanone
SpectraBase Compound ID J1vCaRWKQU1
InChI InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-13-14-24-22-12-10-20-9-11-21(28)17-27(20,5)25(22)15-16-26(23,24)4/h18-20,22-25H,6-17H2,1-5H3
InChIKey RHEVDIMHCWCAIX-UHFFFAOYSA-N
Mol Weight 386.7 g/mol
Molecular Formula C27H46O
Exact Mass 386.354866 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1U7042rPkm1
Name Cholestan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H46O
InChI InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-13-14-24-22-12-10-20-9-11-21(28)17-27(20,5)25(22)15-16-26(23,24)4/h18-20,22-25H,6-17H2,1-5H3
InChIKey RHEVDIMHCWCAIX-UHFFFAOYSA-N
Molecular Weight 386.664 g/mol
SMILES C1C2C(C3CCC4(C(C3CC2)CCC4C(C)CCCC(C)C)C)(CC(C1)=O)C
SPLASH splash10-001i-9862000000-7d9b7be6a37ce85aa7b7
Synonyms 17-(1,5-Dimethylhexyl)-10,13-dimethylhexadecahydrocyclopenta[a]phenanthren-2-one 17-(1,5-Dimethyl-hexyl)-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-2- 1-(1,5-Dimethylhexyl)-9a,11a-dimethylhexadecahydrocyclopenta[a]phenanthren-2-one 10,13-dimethyl-17-(6-methylheptan-2-yl)-1,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-2-one 17-(1,5-dimethylhexyl)-10,13-dimethyl-1,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-2-one
Wiley ID 1475297