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(2E)-3-[5-(4-chlorophenyl)-2-furyl]-2-cyano-N-(4-fluorophenyl)-2-propenamide
SpectraBase Compound ID CmaKouaiCpk
InChI InChI=1S/C20H12ClFN2O2/c21-15-3-1-13(2-4-15)19-10-9-18(26-19)11-14(12-23)20(25)24-17-7-5-16(22)6-8-17/h1-11H,(H,24,25)/b14-11+
InChIKey RMHMBAVPBIMEPW-SDNWHVSQSA-N
Mol Weight 366.78 g/mol
Molecular Formula C20H12ClFN2O2
Exact Mass 366.057133 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LXC8ycJ1uOT
Name (2E)-3-[5-(4-Chlorophenyl)-2-furyl]-2-cyano-N-(4-fluorophenyl)-2-propenamide
Comments Computed using HOSE algorithm
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Exact Mass 366.057133495 u
Formula C20H12ClFN2O2
InChI InChI=1S/C20H12ClFN2O2/c21-15-3-1-13(2-4-15)19-10-9-18(26-19)11-14(12-23)20(25)24-17-7-5-16(22)6-8-17/h1-11H,(H,24,25)/b14-11+
InChIKey RMHMBAVPBIMEPW-SDNWHVSQSA-N
Molecular Weight 366.779 g/mol
SMILES N(C(\C(=C\C=1OC(C2=CC=C(C=C2)Cl)=CC1)C#N)=O)C1=CC=C(C=C1)F