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4-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenyl acetate
SpectraBase Compound ID Hsrgualceig
InChI InChI=1S/C18H13N3O2/c1-12(22)23-15-8-6-13(7-9-15)10-14(11-19)18-20-16-4-2-3-5-17(16)21-18/h2-10H,1H3,(H,20,21)/b14-10+
InChIKey XMGIOOYJWUWFIY-GXDHUFHOSA-N
Mol Weight 303.32 g/mol
Molecular Formula C18H13N3O2
Exact Mass 303.100777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I0GO39GTRrl
Name 4-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenyl acetate
Alternate Name(s) 4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenyl acetate Propennitrile,3-(4-acetoxyphenyl)-2-(2-benzoimidazolyl)
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Formula C18H13N3O2
InChI InChI=1S/C18H13N3O2/c1-12(22)23-15-8-6-13(7-9-15)10-14(11-19)18-20-16-4-2-3-5-17(16)21-18/h2-10H,1H3,(H,20,21)/b14-10+
InChIKey XMGIOOYJWUWFIY-GXDHUFHOSA-N
Molecular Weight 303.321 g/mol
SMILES [nH]1c2ccccc2nc1\C(=C\c1ccc(OC(=O)C)cc1)C#N
SPLASH splash10-0udr-9747000000-207fdfe0cb2d89eddad5
Wiley ID 1451831