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2-Benzoyl-3-(4-acetyl-phenyl)cyclohex-2-enone
SpectraBase Compound ID 6DXL7RZ3eEm
InChI InChI=1S/C21H18O3/c1-14(22)15-10-12-16(13-11-15)18-8-5-9-19(23)20(18)21(24)17-6-3-2-4-7-17/h2-4,6-7,10-13H,5,8-9H2,1H3
InChIKey UNPFMIGLDOVGEC-UHFFFAOYSA-N
Mol Weight 318.37 g/mol
Molecular Formula C21H18O3
Exact Mass 318.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Ukfg2TQpl7
Name 2-Benzoyl-3-(4-acetyl-phenyl)cyclohex-2-enone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18O3
InChI InChI=1S/C21H18O3/c1-14(22)15-10-12-16(13-11-15)18-8-5-9-19(23)20(18)21(24)17-6-3-2-4-7-17/h2-4,6-7,10-13H,5,8-9H2,1H3
InChIKey UNPFMIGLDOVGEC-UHFFFAOYSA-N
Molecular Weight 318.372 g/mol
SMILES C1(=C(c2ccc(C(=O)C)cc2)CCCC1=O)C(=O)c1ccccc1
SPLASH splash10-066r-0409000000-0cbc12cf36384690392a
Source of Spectrum F4-42-3668-3p
Wiley ID 1674464