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3-(trifluoromethyl)-4-(4-chlorophenylimino)-5-[3-(trifluoromethyl)phenoxy]-1,2,4-triazole
SpectraBase Compound ID BbbwrVbuG58
InChI InChI=1S/C17H9ClF6N4O/c18-12-6-4-10(5-7-12)9-25-28-14(17(22,23)24)26-27-15(28)29-13-3-1-2-11(8-13)16(19,20)21/h1-9H/b25-9+
InChIKey YQGBAHYKADTCLS-YCPBAFNGSA-N
Mol Weight 434.73 g/mol
Molecular Formula C17H9ClF6N4O
Exact Mass 434.036908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8RbSYprgEqw
Name 3-(trifluoromethyl)-4-(4-chlorophenylimino)-5-[3-(trifluoromethyl)phenoxy]-1,2,4-triazole
Alternate Name(s) [1-(4-Chloro-phenyl)-meth-(E)-ylidene]-[3-trifluoromethyl-5-(3-trifluoromethyl-phenoxy)-[1,2,4]triazol-4-yl]-amine (E)-N-(4-chlorobenzylidene)-3-(trifluoromethyl)-5-(3-(trifluoromethyl)phenoxy)-4H-1,2,4-triazol-4-amine
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Formula C17H9ClF6N4O
InChI InChI=1S/C17H9ClF6N4O/c18-12-6-4-10(5-7-12)9-25-28-14(17(22,23)24)26-27-15(28)29-13-3-1-2-11(8-13)16(19,20)21/h1-9H/b25-9+
InChIKey YQGBAHYKADTCLS-YCPBAFNGSA-N
Molecular Weight 434.729 g/mol
SMILES c1([n](c(nn1)Oc1cc(C(F)(F)F)ccc1)\N=C\c1ccc(Cl)cc1)C(F)(F)F
SPLASH splash10-01pa-2910000000-d901fdb0ac013955399f
Source of Spectrum Y-51-E346-4b
Wiley ID 1741540