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2-Amino-1H-benzimidazole-6-carbonitrile
SpectraBase Compound ID 5tb9DEWlyly
InChI InChI=1S/C8H6N4/c9-4-5-1-2-6-7(3-5)12-8(10)11-6/h1-3H,(H3,10,11,12)
InChIKey PNMKRBOIMTZVLQ-UHFFFAOYSA-N
Mol Weight 158.16 g/mol
Molecular Formula C8H6N4
Exact Mass 158.059246 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IaGXzXDwY8J
Name 2-Amino-1H-benzimidazole-6-carbonitrile
CAS Registry Number 63655-40-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6N4
InChI InChI=1S/C8H6N4/c9-4-5-1-2-6-7(3-5)12-8(10)11-6/h1-3H,(H3,10,11,12)
InChIKey PNMKRBOIMTZVLQ-UHFFFAOYSA-N
Molecular Weight 158.164 g/mol
SMILES [nH]1c2c(nc1N)ccc(c2)C#N
SPLASH splash10-0a6r-4900000000-1402fe6682e34c3a839c
Synonyms 1H-benzimidazole-5-carbonitrile, 2-amino- 2-Amino-1H-benzimidazole-5-carbonitrile 2-Amino-3H-benzimidazole-5-carbonitrile 2-Amino-3H-benzoimidazole-5-carbonitrile 2-Azanyl-3H-benzimidazole-5-carbonitrile 5-Cyano-2-aminobenzimidazole BRN 0880339 CCRIS 4358
Wiley ID 1462648