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5-Hydroxy-5a-cholestan-3-one
SpectraBase Compound ID Hu0RzJOrQHX
InChI InChI=1S/C27H46O2/c1-18(2)7-6-8-19(3)22-9-10-23-21-12-16-27(29)17-20(28)11-15-26(27,5)24(21)13-14-25(22,23)4/h18-19,21-24,29H,6-17H2,1-5H3
InChIKey OPSNLRNZVIABPI-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 LerMyq6fKBi
Name 5.BETA.-HYDROXY-CHOLESTAN-3-ONE
Alternate Name(s) 5-HYDROXYCHOLESTAN-3-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H46O2
InChI InChI=1S/C27H46O2/c1-18(2)7-6-8-19(3)22-9-10-23-21-12-16-27(29)17-20(28)11-15-26(27,5)24(21)13-14-25(22,23)4/h18-19,21-24,29H,6-17H2,1-5H3
InChIKey OPSNLRNZVIABPI-UHFFFAOYSA-N
Nominal Mass 402 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C(O)(CC(=O)CC2)CCC2C3C(C(CC3)C(CCCC(C)C)C)(CCC12)C)C
SPLASH splash10-0536-9512000000-8eb1b34ebe3ef1b536f4
Source File Reference LMCM-19314-528Z
Source of Spectrum Copyright (C) Prof. Spiteller, University Bayreuth, Germany