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Z-3-(1-H-1,2,4-TRIAZOL-1-YL)-3-PHENYL-1-(4-CHLOROPHENYL)-2-PROPEN-1-ONE;MINOR_ISOMER
SpectraBase Compound ID 5KbLhonDLgJ
InChI InChI=1S/C17H12ClN3O/c18-15-8-6-14(7-9-15)17(22)10-16(21-12-19-11-20-21)13-4-2-1-3-5-13/h1-12H/b16-10-
InChIKey MXIKIYSMZSQCQH-YBEGLDIGSA-N
Mol Weight 309.76 g/mol
Molecular Formula C17H12ClN3O
Exact Mass 309.06689 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EsO04oFWiH9
Name 1-(4-Chlorophenyl)-3-phenyl-3-(1,2,4-triazol-1-yl)-1-oxo-2-propene
Alternate Name(s) (2Z)-1-(4-Chlorophenyl)-3-phenyl-3-(1H-1,2,4-triazol-1-yl)-2-propen-1-one (Z)-1-(4-chlorophenyl)-3-phenyl-3-(1,2,4-triazol-1-yl)-2-propen-1-one (Z)-1-(4-chlorophenyl)-3-phenyl-3-(1,2,4-triazol-1-yl)prop-2-en-1-one
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Formula C17H12ClN3O
InChI InChI=1S/C17H12ClN3O/c18-15-8-6-14(7-9-15)17(22)10-16(21-12-19-11-20-21)13-4-2-1-3-5-13/h1-12H/b16-10-
InChIKey MXIKIYSMZSQCQH-YBEGLDIGSA-N
Molecular Weight 309.756 g/mol
SMILES c1(ccc(cc1)Cl)C(\C=C\(c1ccccc1)[n]1ncnc1)=O
SPLASH splash10-004i-6910000000-ce5614ca9d5d48384142
Source of Spectrum AD-0-2532-0
Wiley ID 1431140