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(E)-2-(1H-benzimidazol-2-yl)-3-[4-(2-fluorobenzyl)oxy-3,5-dimethoxy-phenyl]acrylonitrile
SpectraBase Compound ID 6HlqUeWxxka
InChI InChI=1S/C25H20FN3O3/c1-30-22-12-16(11-18(14-27)25-28-20-9-5-6-10-21(20)29-25)13-23(31-2)24(22)32-15-17-7-3-4-8-19(17)26/h3-13H,15H2,1-2H3,(H,28,29)/b18-11+
InChIKey OAXNDPHGSXTQAR-WOJGMQOQSA-N
Mol Weight 429.45 g/mol
Molecular Formula C25H20FN3O3
Exact Mass 429.14887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KVatgMjdFOz
Name (E)-2-(1H-benzimidazol-2-yl)-3-[4-(2-fluorobenzyl)oxy-3,5-dimethoxy-phenyl]acrylonitrile
Alternate Name(s) (E)-2-(1H-benzimidazol-2-yl)-3-[4-[(2-fluorophenyl)methoxy]-3,5-dimethoxy-phenyl]prop-2-enenitrile (E)-2-(1H-benzimidazol-2-yl)-3-[4-[(2-fluorophenyl)methoxy]-3,5-dimethoxyphenyl]-2-propenenitrile
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Formula C25H20FN3O3
InChI InChI=1S/C25H20FN3O3/c1-30-22-12-16(11-18(14-27)25-28-20-9-5-6-10-21(20)29-25)13-23(31-2)24(22)32-15-17-7-3-4-8-19(17)26/h3-13H,15H2,1-2H3,(H,28,29)/b18-11+
InChIKey OAXNDPHGSXTQAR-WOJGMQOQSA-N
Molecular Weight 429.451 g/mol
SMILES [nH]1c2ccccc2nc1\C(=C\c1cc(OC)c(c(c1)OC)OCc1c(F)cccc1)C#N
SPLASH splash10-0a4i-6983100000-b77626acc872ff835312
Wiley ID 1442637