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3-({[4-(1,3-benzoxazol-2-yl)-2-methylphenyl]imino}methyl)-1-hydroxy-2-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
SpectraBase Compound ID 4J5LUUeY7kO
InChI InChI=1S/C28H19N5O2/c1-16-13-18(27-32-23-8-4-6-10-25(23)35-27)11-12-21(16)30-15-20-17(2)28(34)33-24-9-5-3-7-22(24)31-26(33)19(20)14-29/h3-13,15,34H,1-2H3/b30-15+
InChIKey YKTLZUMUOIUHFK-FJEPWZHXSA-N
Mol Weight 457.49 g/mol
Molecular Formula C28H19N5O2
Exact Mass 457.153875 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8zCYQ0Nwg3E
Name 3-({[4-(1,3-benzoxazol-2-yl)-2-methylphenyl]imino}methyl)-1-hydroxy-2-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Alternate Name(s) 3-((E)-{[4-(1,3-benzoxazol-2-yl)-2-methylphenyl]imino}methyl)-1-hydroxy-2-methylpyrido[1,2-a]benzimidazole-4-carbonitrile 3-[(4-benzooxazol-2-yl-2-methyl-phenylimino)-methyl]-1-hydroxy-2-methyl-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile
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Formula C28H19N5O2
InChI InChI=1S/C28H19N5O2/c1-16-13-18(27-32-23-8-4-6-10-25(23)35-27)11-12-21(16)30-15-20-17(2)28(34)33-24-9-5-3-7-22(24)31-26(33)19(20)14-29/h3-13,15,34H,1-2H3/b30-15+
InChIKey YKTLZUMUOIUHFK-FJEPWZHXSA-N
Molecular Weight 457.493 g/mol
SMILES OC=1[n]2c(C(=C(C1C)\C=N\c1c(cc(cc1)-c1oc3ccccc3n1)C)C#N)nc1c2cccc1
SPLASH splash10-08fu-9230100000-134868a3ca722d2020bd
Wiley ID 1438536