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1H-1,2,3-Triazole-4-carboxylic acid, 5-amino-1-(4-methylphenyl)-, methyl ester
SpectraBase Compound ID 4i95sEgfDCS
InChI InChI=1S/C11H12N4O2/c1-7-3-5-8(6-4-7)15-10(12)9(13-14-15)11(16)17-2/h3-6H,12H2,1-2H3
InChIKey SSVVZWBHYXWVBU-UHFFFAOYSA-N
Mol Weight 232.24 g/mol
Molecular Formula C11H12N4O2
Exact Mass 232.096026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 53JQLh1FeC
Name 1H-1,2,3-Triazole-4-carboxylic acid, 5-amino-1-(4-methylphenyl)-, methyl ester
Alternate Name(s) Methyl 5-amino-1-(4-methylphenyl)-1H-1,2,3-triazole-4-carboxylate 5-Amino-1-(4-methylphenyl)-4-triazolecarboxylic acid methyl ester Methyl 5-amino-1-(4-methylphenyl)triazole-4-carboxylate Methyl 5-amino-1-(p-tolyl)triazole-4-carboxylate Methyl 5-azanyl-1-(4-methylphenyl)-1,2,3-triazole-4-carboxylate
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Formula C11H12N4O2
InChI InChI=1S/C11H12N4O2/c1-7-3-5-8(6-4-7)15-10(12)9(13-14-15)11(16)17-2/h3-6H,12H2,1-2H3
InChIKey SSVVZWBHYXWVBU-UHFFFAOYSA-N
Molecular Weight 232.243 g/mol
SMILES Nc1c(nn[n]1-c1ccc(cc1)C)C(OC)=O
SPLASH splash10-014m-9810000000-d0326b4e6aa860bc3f0b
Source of Spectrum IY-2-4780-2
Wiley ID 1655785