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5,5-Dimethyl-3-[(E)-2-phenylethenyl]-1-cyclohex-2-enone
SpectraBase Compound ID K5TcRKZ3yhm
InChI InChI=1S/C16H18O/c1-16(2)11-14(10-15(17)12-16)9-8-13-6-4-3-5-7-13/h3-10H,11-12H2,1-2H3/b9-8+
InChIKey DSEMSHBPVBACRO-CMDGGOBGSA-N
Mol Weight 226.32 g/mol
Molecular Formula C16H18O
Exact Mass 226.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ysP1fBU0Mb
Name 5,5-Dimethyl-3-[(E)-2-phenylethenyl]-1-cyclohex-2-enone
Alternate Name(s) 5,5-Dimethyl-3-[(E)-2-phenylethenyl]-2-cyclohexen-1-one 5,5-Dimethyl-3-[(E)-2-phenylethenyl]cyclohex-2-en-1-one 5,5-Dimethyl-3-[(E)-styryl]cyclohex-2-en-1-one
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Formula C16H18O
InChI InChI=1S/C16H18O/c1-16(2)11-14(10-15(17)12-16)9-8-13-6-4-3-5-7-13/h3-10H,11-12H2,1-2H3/b9-8+
InChIKey DSEMSHBPVBACRO-CMDGGOBGSA-N
Molecular Weight 226.319 g/mol
SMILES C1(=CC(=O)CC(C1)(C)C)\C=C\c1ccccc1
SPLASH splash10-0006-0910000000-72574d1d4556c4a0ec76
Source of Spectrum F-50-11505-9
Wiley ID 789450