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2H-[1,2,3]Triazole-4-carboxylic acid, 5-amino-2-phenyl-, 4-methylbenzyl ester
SpectraBase Compound ID B0m3lCleNgs
InChI InChI=1S/C17H16N4O2/c1-12-7-9-13(10-8-12)11-23-17(22)15-16(18)20-21(19-15)14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H2,18,20)
InChIKey XNMNQDOKBYKDCH-UHFFFAOYSA-N
Mol Weight 308.34 g/mol
Molecular Formula C17H16N4O2
Exact Mass 308.127326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2NvzzTaQS0
Name 2H-[1,2,3]Triazole-4-carboxylic acid, 5-amino-2-phenyl-, 4-methylbenzyl ester
Alternate Name(s) (4-methylphenyl)methyl 5-amino-2-phenyltriazole-4-carboxylate (4-methylphenyl)methyl 5-azanyl-2-phenyl-1,2,3-triazole-4-carboxylate 4-Methylbenzyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate 5-Amino-2-phenyl-4-triazolecarboxylic acid (4-methylphenyl)methyl ester 5-Amino-2-phenyl-triazole-4-carboxylic acid (4-methylbenzyl) ester p-Tolylmethyl 5-amino-2-phenyl-triazole-4-carboxylate
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Formula C17H16N4O2
InChI InChI=1S/C17H16N4O2/c1-12-7-9-13(10-8-12)11-23-17(22)15-16(18)20-21(19-15)14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H2,18,20)
InChIKey XNMNQDOKBYKDCH-UHFFFAOYSA-N
Molecular Weight 308.341 g/mol
SMILES Nc1n[n](-c2ccccc2)nc1C(=O)OCc1ccc(cc1)C
SPLASH splash10-0a6r-9601000000-4bcded2acaa93cf0ef19
Wiley ID 1446177