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2H-[1,2,3]Triazole-4-carboxylic acid, 5-amino-2-phenyl-, 4-cyanobenzyl ester
SpectraBase Compound ID D3eZ1T727WM
InChI InChI=1S/C17H13N5O2/c18-10-12-6-8-13(9-7-12)11-24-17(23)15-16(19)21-22(20-15)14-4-2-1-3-5-14/h1-9H,11H2,(H2,19,21)
InChIKey QGAYTFSCIPJAQR-UHFFFAOYSA-N
Mol Weight 319.32 g/mol
Molecular Formula C17H13N5O2
Exact Mass 319.106925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 90IB1QaQyHf
Name 2H-[1,2,3]Triazole-4-carboxylic acid, 5-amino-2-phenyl-, 4-cyanobenzyl ester
Alternate Name(s) (4-cyanophenyl)methyl 5-amino-2-phenyl-triazole-4-carboxylate (4-cyanophenyl)methyl 5-azanyl-2-phenyl-1,2,3-triazole-4-carboxylate 4-Cyanobenzyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate 5-Amino-2-phenyl-4-triazolecarboxylic acid (4-cyanophenyl)methyl ester 5-Amino-2-phenyl-triazole-4-carboxylic acid (4-cyanobenzyl) ester
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Formula C17H13N5O2
InChI InChI=1S/C17H13N5O2/c18-10-12-6-8-13(9-7-12)11-24-17(23)15-16(19)21-22(20-15)14-4-2-1-3-5-14/h1-9H,11H2,(H2,19,21)
InChIKey QGAYTFSCIPJAQR-UHFFFAOYSA-N
Molecular Weight 319.324 g/mol
SMILES Nc1n[n](nc1C(=O)OCc1ccc(cc1)C#N)-c1ccccc1
SPLASH splash10-016r-9704000000-fdfc0f6b80140d785f11
Wiley ID 1446185