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5-Amino-1H-imidazole-4-carbonitrile
SpectraBase Compound ID E77YoDGxSZn
InChI InChI=1S/C4H4N4/c5-1-3-4(6)8-2-7-3/h2H,6H2,(H,7,8)
InChIKey XEPBRDBFOSKYCF-UHFFFAOYSA-N
Mol Weight 108.1 g/mol
Molecular Formula C4H4N4
Exact Mass 108.043596 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K5Rda5ckIb9
Name 5-Amino-1H-imidazole-4-carbonitrile
CAS Registry Number 5098-11-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H4N4
InChI InChI=1S/C4H4N4/c5-1-3-4(6)8-2-7-3/h2H,6H2,(H,7,8)
InChIKey XEPBRDBFOSKYCF-UHFFFAOYSA-N
Molecular Weight 108.104 g/mol
SMILES [nH]1c(c(nc1)C#N)N
SPLASH splash10-0pdi-9400000000-a487696a8b01cc877387
Synonyms 1H-Imidazole-4-carbonitrile, 5-amino- 4-Amino-1H-imidazole-5-carbonitrile 4-Amino-5-cyanoimidazole 4-Aminoimidazole-5-carbonitrile 4-Azanyl-1H-imidazole-5-carbonitrile 5-Amino-4-cyanoimidazole 5-Cyano-4-aminoimidazole Amino-4-carbonitrile-5-imidazole Imidazole-4-carbonitrile, 5-amino- EINECS 225-816-6 NSC 139091
Wiley ID 1485121