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2-(3-Methylanilino)-3-phenyl-[1,2,4]triazolo[5,1-b]quinazolin-9-one
SpectraBase Compound ID 3fmTEmhLbSb
InChI InChI=1S/C22H17N5O/c1-15-8-7-9-16(14-15)23-21-25-27-20(28)18-12-5-6-13-19(18)24-22(27)26(21)17-10-3-2-4-11-17/h2-14H,1H3,(H,23,25)
InChIKey PBQPNPFSOHPJDW-UHFFFAOYSA-N
Mol Weight 367.41 g/mol
Molecular Formula C22H17N5O
Exact Mass 367.14331 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4w6vfM2xVlA
Name 2-(3-Methylanilino)-3-phenyl-[1,2,4]triazolo[5,1-b]quinazolin-9-one
Alternate Name(s) 2-(m-toluidino)-3-phenyl-[1,2,4]triazolo[5,1-b]quinazolin-9-one 2-[(3-methylphenyl)amino]-3-phenyl-[1,2,4]triazolo[5,1-b]quinazolin-9-one
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Formula C22H17N5O
InChI InChI=1S/C22H17N5O/c1-15-8-7-9-16(14-15)23-21-25-27-20(28)18-12-5-6-13-19(18)24-22(27)26(21)17-10-3-2-4-11-17/h2-14H,1H3,(H,23,25)
InChIKey PBQPNPFSOHPJDW-UHFFFAOYSA-N
Molecular Weight 367.412 g/mol
SMILES N(C1=NN2C(=Nc3c(C2=O)cccc3)N1c1ccccc1)c1cc(ccc1)C
SPLASH splash10-014i-0229000000-dde2553e820e51282335
Source of Spectrum K1-2004-3875-7
Wiley ID 1561473