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4-(Benzylidene)-2-methylcyclohexane-1,3-dione
SpectraBase Compound ID JJZiOl100I9
InChI InChI=1S/C14H14O2/c1-10-13(15)8-7-12(14(10)16)9-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3/b12-9+
InChIKey UFOKQHWIRSFZAK-FMIVXFBMSA-N
Mol Weight 214.26 g/mol
Molecular Formula C14H14O2
Exact Mass 214.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AaL5ioGEeoL
Name 4-(Benzylidene)-2-methylcyclohexane-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O2
InChI InChI=1S/C14H14O2/c1-10-13(15)8-7-12(14(10)16)9-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3/b12-9+
InChIKey UFOKQHWIRSFZAK-FMIVXFBMSA-N
Molecular Weight 214.264 g/mol
SMILES C1(\C(=C\c2ccccc2)CCC(C1C)=O)=O
SPLASH splash10-03di-0490000000-125a414cf48c2f5e6dea
Source of Spectrum Y1-44-2990-5
Synonyms (4E)-4-benzylidene-2-methyl-1,3-cyclohexanedione
Wiley ID 1621406