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19-NOR-PREGN-4-ENE-3,20-DIONE-17.ALPHA.-NITRAT
SpectraBase Compound ID FxuuvmWemDD
InChI InChI=1S/C20H27NO5/c1-12(22)20(26-21(24)25)10-8-18-17-5-3-13-11-14(23)4-6-15(13)16(17)7-9-19(18,20)2/h11,15-18H,3-10H2,1-2H3
InChIKey CBSBJSZWSGBMBW-UHFFFAOYSA-N
Mol Weight 361.44 g/mol
Molecular Formula C20H27NO5
Exact Mass 361.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNyUHaptYdL
Name 19-NOR-PREGN-4-ENE-3,20-DIONE-17.ALPHA.-NITRAT
Alternate Name(s) 17-ACETYL-3-OXOESTR-4-EN-17-YL NITRATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H27NO5
InChI InChI=1S/C20H27NO5/c1-12(22)20(26-21(24)25)10-8-18-17-5-3-13-11-14(23)4-6-15(13)16(17)7-9-19(18,20)2/h11,15-18H,3-10H2,1-2H3
InChIKey CBSBJSZWSGBMBW-UHFFFAOYSA-N
Nominal Mass 361 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C1(C(C)=O)(CCC2C3CCC=4C(CCC(=O)C4)C3CCC12C)ON(=O)=O
SPLASH splash10-0006-9540000000-4f53f6461537336aacb6
Source File Reference LMCM-38582-156T
Source of Spectrum Copyright (C) Prof. Spiteller, University Bayreuth, Germany