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2-Methyl-2-(5-oxo-5-phenyl-pent-3-enyl)-cyclohexane-1,3-dione
SpectraBase Compound ID Lop8sLbM4yW
InChI InChI=1S/C18H20O3/c1-18(16(20)11-7-12-17(18)21)13-6-5-10-15(19)14-8-3-2-4-9-14/h2-5,8-10H,6-7,11-13H2,1H3/b10-5+
InChIKey JBOHRSQWTRQRNA-BJMVGYQFSA-N
Mol Weight 284.36 g/mol
Molecular Formula C18H20O3
Exact Mass 284.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I3vpjaVpMnU
Name 2-Methyl-2-(5-oxo-5-phenyl-pent-3-enyl)-cyclohexane-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O3
InChI InChI=1S/C18H20O3/c1-18(16(20)11-7-12-17(18)21)13-6-5-10-15(19)14-8-3-2-4-9-14/h2-5,8-10H,6-7,11-13H2,1H3/b10-5+
InChIKey JBOHRSQWTRQRNA-BJMVGYQFSA-N
Literature Reference DOI 10.1021/ol9014943
Molecular Weight 284.355 g/mol
SMILES C1(C(CCCC1=O)=O)(CC\C=C\C(c1ccccc1)=O)C
SPLASH splash10-0a4l-7900000000-88bc78f4fc569f1ed161
Source of Spectrum A1-11-3778/SMS15-27
Synonyms (E)-2-methyl-2-(5-oxo-5-phenylpent-3-en-1-yl)cyclohexane-1,3-dione
Wiley ID 1757205