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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 97yWoUTnYWG
Name 5,5-Dimethyl-3-styrylcyclohex-2-enone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 226.135765199 u
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
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0003.104
Molecular Weight 226.319 g/mol
Quality 314
Reported Formula C16H18O
SMILES C1=CC(=CC=C1)\C=C\C=1CC(CC(C1)=O)(C)C
SPLASH splash10-002f-0930000000-43d5c56b468241feb73b
Source of Spectrum ARK-2002-21-3a (DOI: 10.3998/ark.5550190.0003.104)
Wiley ID 1902807