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3-(4-Chlorobenzyl)-6-(2-hydroxybenzoyl)-3H-imidazo[4,5-b]pyridine-5-carboxylic acid
SpectraBase Compound ID IxC1EpMIrMB
InChI InChI=1S/C21H14ClN3O4/c22-13-7-5-12(6-8-13)10-25-11-23-16-9-15(18(21(28)29)24-20(16)25)19(27)14-3-1-2-4-17(14)26/h1-9,11,26H,10H2,(H,28,29)
InChIKey YGEVZMOZBHPKSM-UHFFFAOYSA-N
Mol Weight 407.81 g/mol
Molecular Formula C21H14ClN3O4
Exact Mass 407.067284 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzRkrSf2waB
Name 3-(4-Chlorobenzyl)-6-(2-hydroxybenzoyl)-3H-imidazo[4,5-b]pyridine-5-carboxylic acid
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Formula C21H14ClN3O4
InChI InChI=1S/C21H14ClN3O4/c22-13-7-5-12(6-8-13)10-25-11-23-16-9-15(18(21(28)29)24-20(16)25)19(27)14-3-1-2-4-17(14)26/h1-9,11,26H,10H2,(H,28,29)
InChIKey YGEVZMOZBHPKSM-UHFFFAOYSA-N
Molecular Weight 407.813 g/mol
SMILES OC(c1c(C(c2c(cccc2)O)=O)cc2nc[n](c2n1)Cc1ccc(cc1)Cl)=O
SPLASH splash10-004r-3619000000-e884616e81c9af8bfd27
Source of Spectrum F4-43-138-10g
Synonyms 3-[(4-chlorophenyl)methyl]-6-[(2-hydroxyphenyl)-oxomethyl]-5-imidazo[4,5-b]pyridinecarboxylic acid 3-[(4-chlorophenyl)methyl]-6-(2-hydroxybenzoyl)imidazo[4,5-b]pyridine-5-carboxylic acid 3-[(4-chlorophenyl)methyl]-6-(2-hydroxyphenyl)carbonyl-imidazo[4,5-b]pyridine-5-carboxylic acid
Wiley ID 1674993