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2-Hydroxycholestan-3-one
SpectraBase Compound ID D8IdCtBlO5f
InChI InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-11-12-22-20-10-9-19-15-24(28)25(29)16-27(19,5)23(20)13-14-26(21,22)4/h17-23,25,29H,6-16H2,1-5H3
InChIKey TYVUTFWURHMKHD-UHFFFAOYSA-N
Mol Weight 402.7 g/mol
Molecular Formula C27H46O2
Exact Mass 402.349781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BBo92SvfxiL
Name 17-(1,5-DIMETHYLHEXYL)-2-HYDROXY-10,13-DIMETHYLHEXADECAHYDROCYCLOPENTA[a]PHENANTHREN-3-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H46O2
InChI InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-11-12-22-20-10-9-19-15-24(28)25(29)16-27(19,5)23(20)13-14-26(21,22)4/h17-23,25,29H,6-16H2,1-5H3
InChIKey TYVUTFWURHMKHD-UHFFFAOYSA-N
Molecular Weight 402.3486
SMILES OC1CC2(C)C(CC1=O)CCC1C2CCC2(C)C1CCC2C(C)CCCC(C)C
SPLASH splash10-052g-9530100000-2e77cfd7f7c047700bfd
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany