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Pregna-5,16-dien-20-one, 3-(acetyloxy)-, (3.beta.)-
SpectraBase Compound ID B2c3YMTjy4W
InChI InChI=1S/C23H32O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h5,7,17-18,20-21H,6,8-13H2,1-4H3
InChIKey MZWRIOUCMXPLKV-UHFFFAOYSA-N
Mol Weight 356.5 g/mol
Molecular Formula C23H32O3
Exact Mass 356.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7GGEUNS2CUU
Name 3.BETA.-ACETOXY-PREGNA-5,16-DIENE-20-ONE
Alternate Name(s) 20-OXOPREGNA-5,16-DIEN-3-YL ACETATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H32O3
InChI InChI=1S/C23H32O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h5,7,17-18,20-21H,6,8-13H2,1-4H3
InChIKey MZWRIOUCMXPLKV-UHFFFAOYSA-N
Nominal Mass 356 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC3C(CC=C4C3(C)CCC(C4)OC(C)=O)C2CC=C1C(C)=O
SPLASH splash10-0005-9770000000-50ed1904a384bdaadffb
Source File Reference LMCM-48958-480X
Source of Spectrum Copyright (C) Prof. Spiteller, University Bayreuth, Germany