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.omaga.-[1-(4-Methoxyphenyl)-5-methyl-1,2,3-triazole-4-carbonyl]-.omaga.-(1H-1,2,4-triazol-1-yl)acetophenone
SpectraBase Compound ID GXZTNtEZY1P
InChI InChI=1S/C21H18N6O4/c1-14-18(24-25-27(14)16-8-10-17(30-2)11-9-16)21(29)31-20(26-13-22-12-23-26)19(28)15-6-4-3-5-7-15/h3-13,20H,1-2H3
InChIKey AEJJNLHAMMNNCT-UHFFFAOYSA-N
Mol Weight 418.41 g/mol
Molecular Formula C21H18N6O4
Exact Mass 418.138953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID TdkB8gYO28
Name .omaga.-[1-(4-Methoxyphenyl)-5-methyl-1,2,3-triazole-4-carbonyl]-.omaga.-(1H-1,2,4-triazol-1-yl)acetophenone
Alternate Name(s) .omega.-[1-(4-Methoxyphenyl)-5-methyl-1,2,3-triazole-4-carboxyl]-.omega.-(1H-1,2,4-triazol-1-yl)acetophenone 2-Oxo-2-phenyl-1-(1H-1,2,4-triazol-1-yl)ethyl 1-(4-methoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
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Formula C21H18N6O4
InChI InChI=1S/C21H18N6O4/c1-14-18(24-25-27(14)16-8-10-17(30-2)11-9-16)21(29)31-20(26-13-22-12-23-26)19(28)15-6-4-3-5-7-15/h3-13,20H,1-2H3
InChIKey AEJJNLHAMMNNCT-UHFFFAOYSA-N
Molecular Weight 418.413 g/mol
SMILES c1c(ccc(c1)-[n]1nnc(c1C)C(=O)OC(C(c1ccccc1)=O)[n]1cncn1)OC
SPLASH splash10-06vr-4900000000-d7e279e8125f13ea64e1
Source of Spectrum Y1-40B-855-3f
Wiley ID 1744096