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N-(4-chlorophenyl)-N-(2-(2,4-dichlorophenyl)-2-oxoethyl)-2-(1H-1,2,4-triazol-1-yl)acetamide
SpectraBase Compound ID EASnIujXeLr
InChI InChI=1S/C18H13Cl3N4O2/c19-12-1-4-14(5-2-12)25(18(27)9-24-11-22-10-23-24)8-17(26)15-6-3-13(20)7-16(15)21/h1-7,10-11H,8-9H2
InChIKey SIXOLFIPPPGAGT-UHFFFAOYSA-N
Mol Weight 423.69 g/mol
Molecular Formula C18H13Cl3N4O2
Exact Mass 422.010409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2NubWoj4eLD
Name N-(4-chlorophenyl)-N-(2-(2,4-dichlorophenyl)-2-oxoethyl)-2-(1H-1,2,4-triazol-1-yl)acetamide
Appearance Yellow solid
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Formula C18H13Cl3N4O2
InChI InChI=1S/C18H13Cl3N4O2/c19-12-1-4-14(5-2-12)25(18(27)9-24-11-22-10-23-24)8-17(26)15-6-3-13(20)7-16(15)21/h1-7,10-11H,8-9H2
InChIKey SIXOLFIPPPGAGT-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 423.687 g/mol
SMILES C(C[n]1ncnc1)(=O)N(CC(=O)c1c(cc(cc1)Cl)Cl)c1ccc(cc1)Cl
SPLASH splash10-006t-0490000000-c3abe7e6a8bfd3c86a79
Source of Spectrum CN106243053A
Wiley ID 1852875