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(2E)-2-cyano-N-(3,5-dichlorophenyl)-3-(2-ethoxyphenyl)-2-propenamide
SpectraBase Compound ID 25DJsJoj6BB
InChI InChI=1S/C18H14Cl2N2O2/c1-2-24-17-6-4-3-5-12(17)7-13(11-21)18(23)22-16-9-14(19)8-15(20)10-16/h3-10H,2H2,1H3,(H,22,23)/b13-7+
InChIKey HYWYWNUOPDLFFS-NTUHNPAUSA-N
Mol Weight 361.23 g/mol
Molecular Formula C18H14Cl2N2O2
Exact Mass 360.043233 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Eh9PVMntJI7
Name (2E)-2-Cyano-N-(3,5-dichlorophenyl)-3-(2-ethoxyphenyl)-2-propenamide
Comments Computed using HOSE algorithm
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Exact Mass 360.043233097 u
Formula C18H14Cl2N2O2
InChI InChI=1S/C18H14Cl2N2O2/c1-2-24-17-6-4-3-5-12(17)7-13(11-21)18(23)22-16-9-14(19)8-15(20)10-16/h3-10H,2H2,1H3,(H,22,23)/b13-7+
InChIKey HYWYWNUOPDLFFS-NTUHNPAUSA-N
Molecular Weight 361.228 g/mol
SMILES N(C(\C(=C\C1=C(OCC)C=CC=C1)C#N)=O)C=1C=C(Cl)C=C(C1)Cl