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1H-[1,2,3]Triazole-4-carbonitrile, 5-amino-1-benzyl-
SpectraBase Compound ID IVfW4OMoKvL
InChI InChI=1S/C10H9N5/c11-6-9-10(12)15(14-13-9)7-8-4-2-1-3-5-8/h1-5H,7,12H2
InChIKey XWQIUVCDURLODQ-UHFFFAOYSA-N
Mol Weight 199.22 g/mol
Molecular Formula C10H9N5
Exact Mass 199.085795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7oE44UUjtKU
Name 1H-[1,2,3]Triazole-4-carbonitrile, 5-amino-1-benzyl-
Comments Less than 3 mono-isotopic peaks
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Formula C10H9N5
InChI InChI=1S/C10H9N5/c11-6-9-10(12)15(14-13-9)7-8-4-2-1-3-5-8/h1-5H,7,12H2
InChIKey XWQIUVCDURLODQ-UHFFFAOYSA-N
Molecular Weight 199.217 g/mol
SMILES Nc1[n](nnc1C#N)Cc1ccccc1
SPLASH splash10-0006-9200000000-b3dc34f883fd93191c22
Source of Spectrum Y-28-301-3
Synonyms 5-amino-1-(phenylmethyl)-4-triazolecarbonitrile 5-Amino-1-benzyl-1H-1,2,3-triazole-4-carbonitrile 5-amino-1-benzyl-triazole-4-carbonitrile 5-azanyl-1-(phenylmethyl)-1,2,3-triazole-4-carbonitrile
Wiley ID 1196614