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2-(Benzylamino)-3-(2-cyanophenyl)-3H-quinazolin-4-one
SpectraBase Compound ID 7JGmee6zis1
InChI InChI=1S/C22H16N4O/c23-14-17-10-4-7-13-20(17)26-21(27)18-11-5-6-12-19(18)25-22(26)24-15-16-8-2-1-3-9-16/h1-13H,15H2,(H,24,25)
InChIKey ATRQOWFEFOIYOS-UHFFFAOYSA-N
Mol Weight 352.4 g/mol
Molecular Formula C22H16N4O
Exact Mass 352.132411 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcmxfSELUrE
Name 2-(Benzylamino)-3-(2-cyanophenyl)-3H-quinazolin-4-one
Alternate Name(s) 2-[4-oxo-2-[(phenylmethyl)amino]-3-quinazolinyl]benzonitrile 2-[2-(benzylamino)-4-oxoquinazolin-3-yl]benzonitrile 2-[2-(benzylamino)-4-oxo-quinazolin-3-yl]benzonitrile 2-[4-oxidanylidene-2-[(phenylmethyl)amino]quinazolin-3-yl]benzenecarbonitrile
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Formula C22H16N4O
InChI InChI=1S/C22H16N4O/c23-14-17-10-4-7-13-20(17)26-21(27)18-11-5-6-12-19(18)25-22(26)24-15-16-8-2-1-3-9-16/h1-13H,15H2,(H,24,25)
InChIKey ATRQOWFEFOIYOS-UHFFFAOYSA-N
Molecular Weight 352.397 g/mol
SMILES N(C=1N(C(c2c(cccc2)N1)=O)c1c(C#N)cccc1)Cc1ccccc1
SPLASH splash10-0udi-0719000000-ad8b41cdb296572d93df
Source of Spectrum U1-2009-2498-5e
Wiley ID 1662977