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3-Bromobenzyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate
SpectraBase Compound ID 988ekUM3LhL
InChI InChI=1S/C16H13BrN4O2/c17-12-6-4-5-11(9-12)10-23-16(22)14-15(18)20-21(19-14)13-7-2-1-3-8-13/h1-9H,10H2,(H2,18,20)
InChIKey YJZHADQHCRDOIT-UHFFFAOYSA-N
Mol Weight 373.21 g/mol
Molecular Formula C16H13BrN4O2
Exact Mass 372.022189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4alVjAknVqT
Name 3-Bromobenzyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate
Alternate Name(s) (3-bromophenyl)methyl 5-amino-2-phenyl-triazole-4-carboxylate (3-bromophenyl)methyl 5-azanyl-2-phenyl-1,2,3-triazole-4-carboxylate 5-Amino-2-phenyl-4-triazolecarboxylic acid (3-bromophenyl)methyl ester 5-Amino-2-phenyl-triazole-4-carboxylic acid (3-bromobenzyl) ester
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Formula C16H13BrN4O2
InChI InChI=1S/C16H13BrN4O2/c17-12-6-4-5-11(9-12)10-23-16(22)14-15(18)20-21(19-14)13-7-2-1-3-8-13/h1-9H,10H2,(H2,18,20)
InChIKey YJZHADQHCRDOIT-UHFFFAOYSA-N
Molecular Weight 373.210 g/mol
SMILES Nc1c(C(OCc2cccc(c2)Br)=O)n[n](-c2ccccc2)n1
SPLASH splash10-00di-4912000000-0240bcf3f62a297b27b1
Wiley ID 1511698