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Pregn-5-en-20-one, 3,17-dihydroxy-, (3.beta.)-
SpectraBase Compound ID EQKfDa4wkrn
InChI InChI=1S/C21H32O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h4,15-18,23-24H,5-12H2,1-3H3
InChIKey JERGUCIJOXJXHF-UHFFFAOYSA-N
Mol Weight 332.5 g/mol
Molecular Formula C21H32O3
Exact Mass 332.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dhi2PAlIldU
Name 3.BETA.,17.ALPHA.-DIHYDROXY-PREGN-5-ENE-20-ONE
Alternate Name(s) 3,17-DIHYDROXYPREGN-5-EN-20-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H32O3
InChI InChI=1S/C21H32O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h4,15-18,23-24H,5-12H2,1-3H3
InChIKey JERGUCIJOXJXHF-UHFFFAOYSA-N
Nominal Mass 332 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC3C(CC=C4C3(C)CCC(O)C4)C2CCC1(O)C(C)=O
SPLASH splash10-000x-9762000000-c2f273c8e32b6edd16aa
Source File Reference LMCM-39260-894R
Source of Spectrum Copyright (C) Prof. Spiteller, University Bayreuth, Germany