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Cholestan-7-one, (5.alpha.)-
SpectraBase Compound ID BjrqC5cdIHe
InChI InChI=1S/C27H46O/c1-18(2)9-8-10-19(3)21-12-13-22-25-23(14-16-27(21,22)5)26(4)15-7-6-11-20(26)17-24(25)28/h18-23,25H,6-17H2,1-5H3
InChIKey SFRHQVIYMXPVMD-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 7xMf15EBG0x
Name 5.ALPHA.-CHOLESTAN-7-ONE
Alternate Name(s) CHOLESTAN-7-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H46O
InChI InChI=1S/C27H46O/c1-18(2)9-8-10-19(3)21-12-13-22-25-23(14-16-27(21,22)5)26(4)15-7-6-11-20(26)17-24(25)28/h18-23,25H,6-17H2,1-5H3
InChIKey SFRHQVIYMXPVMD-UHFFFAOYSA-N
Nominal Mass 386 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC3C4(C(CCCC4)CC(=O)C3C2CCC1C(C)CCCC(C)C)C
SPLASH splash10-000i-9535000000-644c84083d8a78ee12b0
Source File Reference LMCM-51003-698N
Source of Spectrum Copyright (C) Prof. Spiteller, University Bayreuth, Germany