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6-bromo-1H-benzimidazole-2-carboxylic acid ethyl ester
SpectraBase Compound ID KdPFjIGzem2
InChI InChI=1S/C10H9BrN2O2/c1-2-15-10(14)9-12-7-4-3-6(11)5-8(7)13-9/h3-5H,2H2,1H3,(H,12,13)
InChIKey RATPYWQBBAFDQN-UHFFFAOYSA-N
Mol Weight 269.1 g/mol
Molecular Formula C10H9BrN2O2
Exact Mass 267.984741 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GayrtujdMqv
Name 6-bromo-1H-benzimidazole-2-carboxylic acid ethyl ester
Alternate Name(s) ethyl 5-bromo-1H-benzimidazole-2-carboxylate ethyl 6-bromanyl-1H-benzimidazole-2-carboxylate ethyl 6-bromo-1H-benzimidazole-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C10H9BrN2O2
InChI InChI=1S/C10H9BrN2O2/c1-2-15-10(14)9-12-7-4-3-6(11)5-8(7)13-9/h3-5H,2H2,1H3,(H,12,13)
InChIKey RATPYWQBBAFDQN-UHFFFAOYSA-N
Molecular Weight 269.098 g/mol
SMILES [nH]1c2ccc(cc2nc1C(=O)OCC)Br
SPLASH splash10-0002-0960000000-de94b4ffc72b2236b7c2
Source of Spectrum F-48-6357-10
Wiley ID 1271591