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3.BETA.-ACETOXY-PREGN-5-ENE-7,20-DIONE
SpectraBase Compound ID CQpE4yM7Ys7
InChI InChI=1S/C23H32O4/c1-13(24)17-5-6-18-21-19(8-10-23(17,18)4)22(3)9-7-16(27-14(2)25)11-15(22)12-20(21)26/h12,16-19,21H,5-11H2,1-4H3
InChIKey NHUDOBXYMZWEFY-UHFFFAOYSA-N
Mol Weight 372.5 g/mol
Molecular Formula C23H32O4
Exact Mass 372.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HazG3Jtrq84
Name 3.BETA.-ACETOXY-PREGN-5-ENE-7,20-DIONE
Alternate Name(s) 7,20-DIOXOPREGN-5-EN-3-YL ACETATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H32O4
InChI InChI=1S/C23H32O4/c1-13(24)17-5-6-18-21-19(8-10-23(17,18)4)22(3)9-7-16(27-14(2)25)11-15(22)12-20(21)26/h12,16-19,21H,5-11H2,1-4H3
InChIKey NHUDOBXYMZWEFY-UHFFFAOYSA-N
Nominal Mass 372 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)CCC3C(C(=O)C=C4C3(C)CCC(C4)OC(C)=O)C2CCC1C(C)=O
SPLASH splash10-03dl-9637000000-0c6e8f162e7cda1df3de
Source File Reference LMCM-58114-784D
Source of Spectrum Copyright (C) Prof. Spiteller, University Bayreuth, Germany