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4-(4-Methylbenzoyl)benzonitrile
SpectraBase Compound ID 1ZkQZ2cOdr6
InChI InChI=1S/C15H11NO/c1-11-2-6-13(7-3-11)15(17)14-8-4-12(10-16)5-9-14/h2-9H,1H3
InChIKey TZLPNFGBHSHCDP-UHFFFAOYSA-N
Mol Weight 221.26 g/mol
Molecular Formula C15H11NO
Exact Mass 221.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kd2cO5JA2jD
Name 4-(4-Methylbenzoyl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 221.084063977 u
Formula C15H11NO
InChI InChI=1S/C15H11NO/c1-11-2-6-13(7-3-11)15(17)14-8-4-12(10-16)5-9-14/h2-9H,1H3
InChIKey TZLPNFGBHSHCDP-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201502943
Molecular Weight 221.259 g/mol
Quality 265
SMILES CC1=CC=C(C=C1)C(=O)C1=CC=C(C=C1)C#N
SPLASH splash10-01b9-3960000000-ef319128c175fa8351e2
Source of Spectrum QE-21-17656-17656-2 (DOI: 10.1002/chem.201502943)
Wiley ID 1907401