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ESTR-4-EN-3-ONE, 17-HYDROXY-, (17.BETA.)-
SpectraBase Compound ID J0dY8ZWXLV8
InChI InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3
InChIKey NPAGDVCDWIYMMC-UHFFFAOYSA-N
Mol Weight 274.4 g/mol
Molecular Formula C18H26O2
Exact Mass 274.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7BiGJF1Lcvu
Name 17.BETA.-HYDROXY-ESTRA-4-ENE-3-ONE
Alternate Name(s) 17-HYDROXYESTR-4-EN-3-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H26O2
InChI InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3
InChIKey NPAGDVCDWIYMMC-UHFFFAOYSA-N
Nominal Mass 274 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12(C)C(O)CCC2C2CCC=3C(CCC(=O)C3)C2CC1
SPLASH splash10-05i0-5950000000-c7454c767b6a507d8c3a
Source File Reference LMCM-21904-001C
Source of Spectrum Copyright (C) Prof. Spiteller, University Bayreuth, Germany