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2-(3,4-dimethoxyphenyl)-1H-benzimidazole-5-carboxylic acid
SpectraBase Compound ID IotuBDegXeV
InChI InChI=1S/C16H14N2O4/c1-21-13-6-4-9(8-14(13)22-2)15-17-11-5-3-10(16(19)20)7-12(11)18-15/h3-8H,1-2H3,(H,17,18)(H,19,20)
InChIKey CDFQRYKCDQKTAF-UHFFFAOYSA-N
Mol Weight 298.3 g/mol
Molecular Formula C16H14N2O4
Exact Mass 298.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21NOVMlt8Ox
Name 2-(3,4-dimethoxyphenyl)-1H-benzimidazole-5-carboxylic acid
Alternate Name(s) 2-(3,4-dimethoxyphenyl)-3H-benzimidazole-5-carboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C16H14N2O4
InChI InChI=1S/C16H14N2O4/c1-21-13-6-4-9(8-14(13)22-2)15-17-11-5-3-10(16(19)20)7-12(11)18-15/h3-8H,1-2H3,(H,17,18)(H,19,20)
InChIKey CDFQRYKCDQKTAF-UHFFFAOYSA-N
Molecular Weight 298.298 g/mol
SMILES OC(c1cc2nc([nH]c2cc1)-c1cc(OC)c(cc1)OC)=O
SPLASH splash10-0006-9000000000-b1fafda57d018a5add24
Source of Spectrum D9-334-151-27
Wiley ID 1550842