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Cholesterol -H2O
SpectraBase Compound ID GbCBuJGkDXc
InChI InChI=1S/C27H44/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h6,11-12,19-20,22-25H,7-10,13-18H2,1-5H3
InChIKey RLHIRZFWJBOHHD-UHFFFAOYSA-N
Mol Weight 368.6 g/mol
Molecular Formula C27H44
Exact Mass 368.344301 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8cybBn18nAf
Name CHOLESTA-3,5-DIENE
Alternate Name(s) CHOLEST-3,5-DIENE
CAS Registry Number 747-90-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H44
InChI InChI=1S/C27H44/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h6,11-12,19-20,22-25H,7-10,13-18H2,1-5H3
InChIKey RLHIRZFWJBOHHD-UHFFFAOYSA-N
Nominal Mass 368 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES CC12C(C(C)CCCC(C)C)CCC2C2CC=C3C(CCC=C3)(C)C2CC1
SPLASH splash10-014i-9726000000-5a9bd0d4ea9d3a988328
Source File Reference LMCM-35260-728W
Source of Spectrum Copyright (C) Prof. Spiteller, University Bayreuth, Germany