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1-Benzoyl-3-(2-cyclohexenyl)-2-propanone
SpectraBase Compound ID 5BqHO1HPSqg
InChI InChI=1S/C16H18O2/c17-15(11-13-7-3-1-4-8-13)12-16(18)14-9-5-2-6-10-14/h2-3,5-7,9-10,13H,1,4,8,11-12H2
InChIKey JCPVPWRUZZMRFP-UHFFFAOYSA-N
Mol Weight 242.32 g/mol
Molecular Formula C16H18O2
Exact Mass 242.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AKzS6DS06Rm
Name 1-Benzoyl-3-(2-cyclohexenyl)-2-propanone
Alternate Name(s) 4-(2-cyclohexen-1-yl)-1-phenyl-1,3-butanedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O2
InChI InChI=1S/C16H18O2/c17-15(11-13-7-3-1-4-8-13)12-16(18)14-9-5-2-6-10-14/h2-3,5-7,9-10,13H,1,4,8,11-12H2
InChIKey JCPVPWRUZZMRFP-UHFFFAOYSA-N
Molecular Weight 242.318 g/mol
SMILES C(CC(=O)CC1C=CCCC1)(=O)c1ccccc1
SPLASH splash10-016r-9200000000-360a7fd6430d6f65c526
Source of Spectrum F-53-8075-4
Wiley ID 802498