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3a-Hydroxy-5.beta.-pregnan-20-one
SpectraBase Compound ID 4hYE87dn8D0
InChI InChI=1S/C21H34O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19,23H,4-12H2,1-3H3
InChIKey AURFZBICLPNKBZ-UHFFFAOYSA-N
Mol Weight 318.5 g/mol
Molecular Formula C21H34O2
Exact Mass 318.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CQZ7YLULYzI
Name 3.BETA.-HYDROXY-5.ALPHA.-PREGNAN-20-ONE
Alternate Name(s) 3-HYDROXYPREGNAN-20-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H34O2
InChI InChI=1S/C21H34O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19,23H,4-12H2,1-3H3
InChIKey AURFZBICLPNKBZ-UHFFFAOYSA-N
Nominal Mass 318 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC3C(CCC4C3(C)CCC(O)C4)C2CCC1C(C)=O
SPLASH splash10-015c-9423000000-9bd9c7d807008ea04ad1
Source File Reference LMCM-80142-794D
Source of Spectrum Copyright (C) Prof. Spiteller, University Bayreuth, Germany