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5-(2-nitroanilino)-2H-triazole-4-carbonitrile
SpectraBase Compound ID DP1szHZiodY
InChI InChI=1S/C9H6N6O2/c10-5-7-9(13-14-12-7)11-6-3-1-2-4-8(6)15(16)17/h1-4H,(H2,11,12,13,14)
InChIKey AAIRMENEOFGJND-UHFFFAOYSA-N
Mol Weight 230.19 g/mol
Molecular Formula C9H6N6O2
Exact Mass 230.055223 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BtTvXiKYgwZ
Name 5-(2-nitroanilino)-2H-triazole-4-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C9H6N6O2
InChI InChI=1S/C9H6N6O2/c10-5-7-9(13-14-12-7)11-6-3-1-2-4-8(6)15(16)17/h1-4H,(H2,11,12,13,14)
InChIKey AAIRMENEOFGJND-UHFFFAOYSA-N
Molecular Weight 230.187 g/mol
SMILES [nH]1c(c(nn1)C#N)Nc1c(N(=O)=O)cccc1
SPLASH splash10-0udi-9000000000-ee86c6f92b5e99d88597
Source of Spectrum Y-39-1295-10
Synonyms 5-[(2-nitrophenyl)amino]-2H-1,2,3-triazole-4-carbonitrile
Wiley ID 1528753