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3.BETA.-HYDROXY-PREGN-5-ENE-7,20-DIONE
SpectraBase Compound ID 13zHVFPMOw3
InChI InChI=1S/C21H30O3/c1-12(22)15-4-5-16-19-17(7-9-21(15,16)3)20(2)8-6-14(23)10-13(20)11-18(19)24/h11,14-17,19,23H,4-10H2,1-3H3
InChIKey WNHLZNUVEVVTSY-UHFFFAOYSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GgcGQTLAgmN
Name 3.BETA.-HYDROXY-PREGN-5-ENE-7,20-DIONE
Alternate Name(s) 3-HYDROXYPREGN-5-ENE-7,20-DIONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-12(22)15-4-5-16-19-17(7-9-21(15,16)3)20(2)8-6-14(23)10-13(20)11-18(19)24/h11,14-17,19,23H,4-10H2,1-3H3
InChIKey WNHLZNUVEVVTSY-UHFFFAOYSA-N
Nominal Mass 330 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC3C(C(=O)C=C4C3(C)CCC(O)C4)C2CCC1C(C)=O
SPLASH splash10-001l-9523000000-9cf5a105b40669ecae1e
Source File Reference LMCM-24482-718L
Source of Spectrum Copyright (C) Prof. Spiteller, University Bayreuth, Germany