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3-(4-Cyanophenyl)-1-phenylnonane-1,4-dione
SpectraBase Compound ID AEp0bsdEeMZ
InChI InChI=1S/C22H23NO2/c1-2-3-5-10-21(24)20(18-13-11-17(16-23)12-14-18)15-22(25)19-8-6-4-7-9-19/h4,6-9,11-14,20H,2-3,5,10,15H2,1H3
InChIKey OUFGGKKAOPAEMY-UHFFFAOYSA-N
Mol Weight 333.43 g/mol
Molecular Formula C22H23NO2
Exact Mass 333.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8o2SLwQwpCA
Name 3-(4-Cyanophenyl)-1-phenylnonane-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO2
InChI InChI=1S/C22H23NO2/c1-2-3-5-10-21(24)20(18-13-11-17(16-23)12-14-18)15-22(25)19-8-6-4-7-9-19/h4,6-9,11-14,20H,2-3,5,10,15H2,1H3
InChIKey OUFGGKKAOPAEMY-UHFFFAOYSA-N
Molecular Weight 333.431 g/mol
SMILES C(CC(C(CCCCC)=O)c1ccc(cc1)C#N)(=O)c1ccccc1
SPLASH splash10-052b-9210000000-63f85b80454ff5c9678d
Source of Spectrum CV-2004-2401-5
Synonyms 4-[2-oxo-1-(2-oxo-2-phenylethyl)heptyl]benzonitrile
Wiley ID 1611586