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ESTR-5(10)-EN-3,17-DIONE
SpectraBase Compound ID EzTTfUtnDOo
InChI InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h14-16H,2-10H2,1H3
InChIKey RORYLAUXKSWMQL-UHFFFAOYSA-N
Mol Weight 272.39 g/mol
Molecular Formula C18H24O2
Exact Mass 272.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJgMKQtqlrh
Name ESTR-5(10)-ENE-3,17-DIONE
CAS Registry Number 3962-66-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H24O2
InChI InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h14-16H,2-10H2,1H3
InChIKey RORYLAUXKSWMQL-UHFFFAOYSA-N
Nominal Mass 272 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C1=2CCC(CC2CCC2C1CCC1(C2CCC1=O)C)=O
SPLASH splash10-00dl-5790000000-d614ff6d3a439f077906
Source File Reference LMCM-34770-628Y
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK