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6-Methyl-2-phenyl-3-(hexynyl)cyclohexa-2,5-dien-1,4-dione
SpectraBase Compound ID 8t6mZdaR7ej
InChI InChI=1S/C19H18O2/c1-3-4-5-9-12-16-17(20)13-14(2)19(21)18(16)15-10-7-6-8-11-15/h6-8,10-11,13H,3-5H2,1-2H3
InChIKey QJJBRNAVXHDWAE-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C19H18O2
Exact Mass 278.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BvYuiThWynG
Name 6-Methyl-2-phenyl-3-(hexynyl)cyclohexa-2,5-dien-1,4-dione
Alternate Name(s) 2-(1-hexynyl)-5-methyl-3-phenylbenzo-1,4-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O2
InChI InChI=1S/C19H18O2/c1-3-4-5-9-12-16-17(20)13-14(2)19(21)18(16)15-10-7-6-8-11-15/h6-8,10-11,13H,3-5H2,1-2H3
InChIKey QJJBRNAVXHDWAE-UHFFFAOYSA-N
Molecular Weight 278.351 g/mol
SMILES C1(=C(C(=O)C=C(C1=O)C)C#CCCCC)c1ccccc1
SPLASH splash10-000i-0490000000-f5e84f530da4ab68bed8
Source of Spectrum F-50-2013-12
Wiley ID 1282538