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2-Chlorobenzyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate
SpectraBase Compound ID 2IQJIjjM5mK
InChI InChI=1S/C16H13ClN4O2/c17-13-9-5-4-6-11(13)10-23-16(22)14-15(18)20-21(19-14)12-7-2-1-3-8-12/h1-9H,10H2,(H2,18,20)
InChIKey BQEBZNXJVVPVSR-UHFFFAOYSA-N
Mol Weight 328.76 g/mol
Molecular Formula C16H13ClN4O2
Exact Mass 328.072703 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3w1vbamnxI
Name 2-Chlorobenzyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClN4O2
InChI InChI=1S/C16H13ClN4O2/c17-13-9-5-4-6-11(13)10-23-16(22)14-15(18)20-21(19-14)12-7-2-1-3-8-12/h1-9H,10H2,(H2,18,20)
InChIKey BQEBZNXJVVPVSR-UHFFFAOYSA-N
Molecular Weight 328.759 g/mol
SMILES Nc1c(C(OCc2c(cccc2)Cl)=O)n[n](-c2ccccc2)n1
SPLASH splash10-004i-3914000000-48814783e8fd419e36db
Synonyms (2-chlorophenyl)methyl 5-amino-2-phenyl-triazole-4-carboxylate (2-chlorophenyl)methyl 5-azanyl-2-phenyl-1,2,3-triazole-4-carboxylate 5-Amino-2-phenyl-4-triazolecarboxylic acid (2-chlorophenyl)methyl ester 5-Amino-2-phenyl-triazole-4-carboxylic acid (2-chlorobenzyl) ester
Wiley ID 1511690