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N-(2-p-Tolyloxy-5-trifluoromethyl-phenyl)-nicotinamide

View entire compound with spectra: 2 NMR, and 1 MS (GC)

N-(2-p-Tolyloxy-5-trifluoromethyl-phenyl)-nicotinamide
SpectraBase Compound ID 8nzFyroSMKg
InChI InChI=1S/C20H15F3N2O2/c1-13-4-7-16(8-5-13)27-18-9-6-15(20(21,22)23)11-17(18)25-19(26)14-3-2-10-24-12-14/h2-12H,1H3,(H,25,26)
InChIKey MPFPZIJBXYKDIG-UHFFFAOYSA-N
Mol Weight 372.35 g/mol
Molecular Formula C20H15F3N2O2
Exact Mass 372.108562 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7thLf5z3UtJ
Name N-(2-p-Tolyloxy-5-trifluoromethyl-phenyl)-nicotinamide
Comments Computed using HOSE algorithm
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Exact Mass 372.108562218 u
Formula C20H15F3N2O2
InChI InChI=1S/C20H15F3N2O2/c1-13-4-7-16(8-5-13)27-18-9-6-15(20(21,22)23)11-17(18)25-19(26)14-3-2-10-24-12-14/h2-12H,1H3,(H,25,26)
InChIKey MPFPZIJBXYKDIG-UHFFFAOYSA-N
Molecular Weight 372.347 g/mol
SMILES C(C1=CC(NC(C=2C=NC=CC2)=O)=C(C=C1)OC1=CC=C(C)C=C1)(F)(F)F