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3.BETA.-HYDROXY-CHOLEST-5-EN

View entire compound with spectra: 125 NMR, and 171 MS (GC)

3.BETA.-HYDROXY-CHOLEST-5-EN
SpectraBase Compound ID AM1PbI5gSNU
InChI InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3
InChIKey HVYWMOMLDIMFJA-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 BvDwG0gXi6h
Name 3.BETA.-HYDROXY-CHOLEST-5-EN
Alternate Name(s) PROVITAMIN D CHOLEST-5-EN-3-OL (3.BETA.)- CHOLESTEROL CHOLEST-5-EN-3-OL
CAS Registry Number 57-88-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H46O
InChI InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3
InChIKey HVYWMOMLDIMFJA-UHFFFAOYSA-N
Nominal Mass 386 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES CC12C(C(C)CCCC(C)C)CCC2C2CC=C3CC(O)CCC3(C)C2CC1
SPLASH splash10-000i-9736000000-891c14dd1abf9ca34147
Source File Reference LMCM-79743-957H
Source of Spectrum Copyright (C) Prof. Spiteller, University Bayreuth, Germany