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6-Methyl-2-phenyl-3-(2-phenylethynyl)cyclohexa-2,5-dien-1,4-dione
SpectraBase Compound ID FzOVs184Adn
InChI InChI=1S/C21H14O2/c1-15-14-19(22)18(13-12-16-8-4-2-5-9-16)20(21(15)23)17-10-6-3-7-11-17/h2-11,14H,1H3
InChIKey XFEUYUHLBGRLJF-UHFFFAOYSA-N
Mol Weight 298.34 g/mol
Molecular Formula C21H14O2
Exact Mass 298.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BTjApsGb7td
Name 6-Methyl-2-phenyl-3-(2-phenylethynyl)cyclohexa-2,5-dien-1,4-dione
Alternate Name(s) 5-Methyl-3-phenyl-2-(phenylethynyl)benzo-1,4-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H14O2
InChI InChI=1S/C21H14O2/c1-15-14-19(22)18(13-12-16-8-4-2-5-9-16)20(21(15)23)17-10-6-3-7-11-17/h2-11,14H,1H3
InChIKey XFEUYUHLBGRLJF-UHFFFAOYSA-N
Molecular Weight 298.341 g/mol
SMILES C1(=C(C(=O)C(=CC1=O)C)c1ccccc1)C#Cc1ccccc1
SPLASH splash10-0002-0190000000-be92767cc337cfb29598
Source of Spectrum F-50-2013-12
Wiley ID 1301579