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1-(4-Amino-furazan-3-yl)-5-phenyl-1H-[1,2,3]triazole-4-carboxylic acid ethyl ester
SpectraBase Compound ID 3HjcljRBs1n
InChI InChI=1S/C13H12N6O3/c1-2-21-13(20)9-10(8-6-4-3-5-7-8)19(18-15-9)12-11(14)16-22-17-12/h3-7H,2H2,1H3,(H2,14,16)
InChIKey XZSMHRAGXUUTQP-UHFFFAOYSA-N
Mol Weight 300.28 g/mol
Molecular Formula C13H12N6O3
Exact Mass 300.097088 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8W0MLwk8EOP
Name 1-(4-Amino-furazan-3-yl)-5-phenyl-1H-[1,2,3]triazole-4-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N6O3
InChI InChI=1S/C13H12N6O3/c1-2-21-13(20)9-10(8-6-4-3-5-7-8)19(18-15-9)12-11(14)16-22-17-12/h3-7H,2H2,1H3,(H2,14,16)
InChIKey XZSMHRAGXUUTQP-UHFFFAOYSA-N
Molecular Weight 300.278 g/mol
SMILES Nc1c(-[n]2nnc(c2-c2ccccc2)C(=O)OCC)non1
SPLASH splash10-0002-1900000000-5dec0db2486966feec7f
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-4-triazolecarboxylic acid ethyl ester 1-(4-aminofurazan-3-yl)-5-phenyl-triazole-4-carboxylic acid ethyl ester Ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazole-4-carboxylate Ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-triazole-4-carboxylate Ethyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-phenyl-1,2,3-triazole-4-carboxylate
Wiley ID 1465973