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5.alpha.-Hydroxy-6-ketocholesterol
SpectraBase Compound ID Iz9S5uammi6
InChI InChI=1S/C27H46O3/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24(29)27(30)16-19(28)11-14-26(27,5)23(20)12-13-25(21,22)4/h17-23,28,30H,6-16H2,1-5H3/t18?,19-,20-,21+,22-,23-,25+,26+,27-/m0/s1
InChIKey SJZZRXMQSAXCFD-ZIUJSLSYSA-N
Mol Weight 418.7 g/mol
Molecular Formula C27H46O3
Exact Mass 418.344695 g/mol
Enantiomer InChIKey SJZZRXMQSAXCFD-VLAWGIAHSA-N
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
  • Cholestane-6-oxo-5.beta.,3.alpha.-diol

NIST/EPA/NIH MS/MS Mass Spectral Library 2020 LR

Author: NIST

The NIST/EPA/NIH MS/MS 2020 libraries contain over 1,320,000 spectra for over 185,500 ions. The MS/MS libraries also contain metabolites, peptides (including biologically-relevant peptides), contaminants, lipids, and more. Learn more.

NIST/EPA/NIH MS/MS Mass Spectral Library 2020 HR

Author: NIST

The NIST/EPA/NIH MS/MS 2020 libraries contain over 1,320,000 spectra for over 185,500 ions. The MS/MS libraries also contain metabolites, peptides (including biologically-relevant peptides), contaminants, lipids, and more. Learn more.

Biologically and Environmentally Important Organic Compounds: GCMS Library

Author: Valery A. Isidorov

This library features mass spectra for biologically and environmentally important organic compounds in the form of their trimethylsilyl derivatives (TMS), along with their TMS linear temperature programmed chromatographic retention indices. Learn more.

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