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Cortexolone
SpectraBase Compound ID 9XEqjkz6SQo
InChI InChI=1S/C21H30O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-17,22,25H,3-10,12H2,1-2H3/t15-,16+,17+,19+,20+,21+/m1/s1
InChIKey WHBHBVVOGNECLV-OBQKJFGGSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol
Enantiomer InChIKey WHBHBVVOGNECLV-GQENOEBFSA-N
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Steraloids Inc.
Source of Spectrum Forensic Spectral Research
Catalog Number Q1610-000
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number 119644
Copyright Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved.
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 119644
Solvent CDCl3 & DMSO-d6
Copyright Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved.
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Polysol
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 119644
Solvent CDCl3 & DMSO-d6
Copyright Copyright © 2013-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Steraloids Inc.
Source of Spectrum Forensic Spectral Research
Catalog Number Q1610-000
Copyright Copyright © 2017-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2017-2024 John Wiley & Sons, Inc. All Rights Reserved.
Catalog Number 119644
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number 11964-4
Technique KBr WAFER
Copyright Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Steraloids
Source of Spectrum Forensic Spectral Research
Catalog Number Q1610-000
Technique KBr1 0.74mg
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 119644
Technique Mull
Copyright Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Methanol
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum Prof. Spiteller, University Bayreuth, Germany
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum FM-2019-840-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum FM-2019-841-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum FM-2019-842-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum FM-2019-843-0
  • 11-Deoxycortisol
  • 17,21-Dihydroxypregn-4-ene-3,20-dione
  • 17,21-DIHYDROXYPREGN-4-EN-3,20-DION,(CORTEXOLON)
  • 17-ALPHA,21-DIHYDROXYPREGN-4-EN-3,20-DION
  • Pregn-4-ene-3,20-dione, 17,21-dihydroxy-
  • REICHSTEINS SUBSTANCE S
  • cortexolone, 2TMS, 1MEOX
  • 17.ALPHA.,21-DIHYDROXY-PREGN-4-ENE-3,20-DIONE
  • (8R,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one
Title Journal or Book Year
A carbon-13 nuclear magnetic resonance study of the 1,4-diene analogues of steroid hormones and related steroids Organic Magnetic Resonance 1984
13C n.m.r. spectra of steroids —a survey and commentary Organic Magnetic Resonance 1977

This compound is available in the following databases:

Sigma-Aldrich Library of Raman Spectra

Author: Wiley/Sigma-Aldrich

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KnowItAll NMR Spectral Library

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KnowItAll Mass Spectral Library

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The KnowItAll Mass Spectral Library offers a comprehensive collection of mass spectra, including the renowned Wiley Registry, and access to a wide range of compounds including pure organics, drugs, steroids, additives, geochemicals, petrochemicals, biomarkers, and more. Learn more.

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