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.omaga.-[1-(4-Chlorophenyl)-5-methyl-1,2,3-triazole-4-carbonyl]-.omaga.-(1H-1,2,4-triazol-1-yl)acetophenone
SpectraBase Compound ID D3SbiH2ztlh
InChI InChI=1S/C20H15ClN6O3/c1-13-17(24-25-27(13)16-9-7-15(21)8-10-16)20(29)30-19(26-12-22-11-23-26)18(28)14-5-3-2-4-6-14/h2-12,19H,1H3
InChIKey AOVLJKSXZCYDGF-UHFFFAOYSA-N
Mol Weight 422.83 g/mol
Molecular Formula C20H15ClN6O3
Exact Mass 422.089416 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4xGHX3wSxxF
Name .omaga.-[1-(4-Chlorophenyl)-5-methyl-1,2,3-triazole-4-carbonyl]-.omaga.-(1H-1,2,4-triazol-1-yl)acetophenone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15ClN6O3
InChI InChI=1S/C20H15ClN6O3/c1-13-17(24-25-27(13)16-9-7-15(21)8-10-16)20(29)30-19(26-12-22-11-23-26)18(28)14-5-3-2-4-6-14/h2-12,19H,1H3
InChIKey AOVLJKSXZCYDGF-UHFFFAOYSA-N
Molecular Weight 422.832 g/mol
SMILES c1cc(ccc1Cl)-[n]1nnc(c1C)C(=O)OC(C(c1ccccc1)=O)[n]1cncn1
SPLASH splash10-0a4i-0900000000-25b231ed52e17656083c
Source of Spectrum Y1-40B-855-3a
Synonyms 1-(4-Chlorophenyl)-5-methyl-4-triazolecarboxylic acid [2-oxo-2-phenyl-1-(1,2,4-triazol-1-yl)ethyl] ester .omega.-[1-(4-Chlorophenyl)-5-methyl-1,2,3-triazole-4-carboxyl ]-.omega.-(1H-1, 2, 4-triazol-1-yl)acetophenone [2-oxo-2-phenyl-1-(1,2,4-triazol-1-yl)ethyl] 1-(4-chlorophenyl)-5-methyltriazole-4-carboxylate [2-oxo-2-phenyl-1-(1,2,4-triazol-1-yl)ethyl] 1-(4-chlorophenyl)-5-methyl-triazole-4-carboxylate [2-oxidanylidene-2-phenyl-1-(1,2,4-triazol-1-yl)ethyl] 1-(4-chlorophenyl)-5-methyl-1,2,3-triazole-4-carboxylate 2-Oxo-2-phenyl-1-(1H-1,2,4-triazol-1-yl)ethyl 1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Wiley ID 1744094