For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3b-Hydroxy-5a-cholestan-6-one
SpectraBase Compound ID C4Tsg1TayCQ
InChI InChI=1S/C27H46O2/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/h17-24,28H,6-16H2,1-5H3
InChIKey JQMQKOQOLPGBBE-UHFFFAOYSA-N
Mol Weight 402.7 g/mol
Molecular Formula C27H46O2
Exact Mass 402.349781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BduAmjBUbW3
Name 17-(1,5-DIMETHYLHEXYL)-3,5-DIHYDROXY-10,13-DIMETHYLHEXADECAHYDROCYCLOPENTA[a]PHENANTHREN-6-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H46O3
InChI InChI=1S/C27H46O2/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/h17-24,28H,6-16H2,1-5H3
InChIKey JQMQKOQOLPGBBE-UHFFFAOYSA-N
Molecular Weight 402.3486
SMILES OC1CCC2(C)C3CCC4(C)C(CCC4C3CC(=O)C2C1)C(CCCC(C)C)C
SPLASH splash10-05mo-9512100000-10762421e2951a0ceab9
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany