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4-(3-Methylbenzoyl)benzonitrile

View entire compound with spectra: 1 MS (GC)

4-(3-Methylbenzoyl)benzonitrile
SpectraBase Compound ID LKhqFcmxA9K
InChI InChI=1S/C15H11NO/c1-11-3-2-4-14(9-11)15(17)13-7-5-12(10-16)6-8-13/h2-9H,1H3
InChIKey HZYDTWITIQTISZ-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 1eTZ6vQ3b43
Name 4-(3-Methylbenzoyl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11NO
InChI InChI=1S/C15H11NO/c1-11-3-2-4-14(9-11)15(17)13-7-5-12(10-16)6-8-13/h2-9H,1H3
InChIKey HZYDTWITIQTISZ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/acs.joc.5b01160
Molecular Weight 221.259 g/mol
SMILES C(c1ccc(cc1)C(c1cc(ccc1)C)=O)#N
SPLASH splash10-014i-4930000000-b4278e98c22ad5479418
Source of Spectrum J-80-7814-6i
Wiley ID 1806759