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1-Methyl 4-(3'-bromo-4',5'-dimethoxyphenyl)-5-(3''-fluoro-4''-methoxyphenyl)-imidazole
SpectraBase Compound ID 7nYyj9AtBc
InChI InChI=1S/C19H18BrFN2O3/c1-23-10-22-17(12-7-13(20)19(26-4)16(9-12)25-3)18(23)11-5-6-15(24-2)14(21)8-11/h5-10H,1-4H3
InChIKey KQURGGHNEBEDPJ-UHFFFAOYSA-N
Mol Weight 421.27 g/mol
Molecular Formula C19H18BrFN2O3
Exact Mass 420.048484 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DxIsWB31chF
Name 1-Methyl 4-(3'-bromo-4',5'-dimethoxyphenyl)-5-(3''-fluoro-4''-methoxyphenyl)-imidazole
Appearance Colorless gum
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Formula C19H18BrFN2O3
InChI InChI=1S/C19H18BrFN2O3/c1-23-10-22-17(12-7-13(20)19(26-4)16(9-12)25-3)18(23)11-5-6-15(24-2)14(21)8-11/h5-10H,1-4H3
InChIKey KQURGGHNEBEDPJ-UHFFFAOYSA-N
Instrument Name VARIAN MAT 311A
Ionization Type EI
Molecular Weight 421.266 g/mol
SMILES c1nc(c([n]1C)-c1cc(c(cc1)OC)F)-c1cc(c(c(c1)OC)OC)Br
SPLASH splash10-066r-6600900000-1ef3a1c9360144d86a80
Source of Spectrum CN102985410A
Thin-Layer Chromatography Rf = 0.67 (ethyl acetate)
Wiley ID 1847172