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Propionamide, N-(4-cyanomethylphenyl)-3-(4-methoxyphenyl)-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Propionamide, N-(4-cyanomethylphenyl)-3-(4-methoxyphenyl)-
SpectraBase Compound ID G949bTorw0w
InChI InChI=1S/C18H18N2O2/c1-22-17-9-4-14(5-10-17)6-11-18(21)20-16-7-2-15(3-8-16)12-13-19/h2-5,7-10H,6,11-12H2,1H3,(H,20,21)
InChIKey JKTPKLALKQHNKX-UHFFFAOYSA-N
Mol Weight 294.35 g/mol
Molecular Formula C18H18N2O2
Exact Mass 294.136828 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6GREB1lXOSC
Name Propionamide, N-(4-cyanomethylphenyl)-3-(4-methoxyphenyl)-
Comments Computed using HOSE algorithm
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Exact Mass 294.136827826 u
Formula C18H18N2O2
InChI InChI=1S/C18H18N2O2/c1-22-17-9-4-14(5-10-17)6-11-18(21)20-16-7-2-15(3-8-16)12-13-19/h2-5,7-10H,6,11-12H2,1H3,(H,20,21)
InChIKey JKTPKLALKQHNKX-UHFFFAOYSA-N
Molecular Weight 294.354 g/mol
SMILES COC1=CC=C(CCC(NC2=CC=C(CC#N)C=C2)=O)C=C1