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N-(5-chloro-2-pyridinyl)-4-[(2,2,2-trifluoroethoxy)methyl]benzamide

View entire compound with spectra: 2 NMR

N-(5-chloro-2-pyridinyl)-4-[(2,2,2-trifluoroethoxy)methyl]benzamide
SpectraBase Compound ID KWv67eyMite
InChI InChI=1S/C15H12ClF3N2O2/c16-12-5-6-13(20-7-12)21-14(22)11-3-1-10(2-4-11)8-23-9-15(17,18)19/h1-7H,8-9H2,(H,20,21,22)
InChIKey QRCUSDFZOURDME-UHFFFAOYSA-N
Mol Weight 344.72 g/mol
Molecular Formula C15H12ClF3N2O2
Exact Mass 344.05394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KDYJKmWRlDm
Name N-(5-Chloro-2-pyridinyl)-4-[(2,2,2-trifluoroethoxy)methyl]benzamide
Comments Computed using HOSE algorithm
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Exact Mass 344.053939821 u
Formula C15H12ClF3N2O2
InChI InChI=1S/C15H12ClF3N2O2/c16-12-5-6-13(20-7-12)21-14(22)11-3-1-10(2-4-11)8-23-9-15(17,18)19/h1-7H,8-9H2,(H,20,21,22)
InChIKey QRCUSDFZOURDME-UHFFFAOYSA-N
Molecular Weight 344.721 g/mol
SMILES N(C(C1=CC=C(C=C1)COCC(F)(F)F)=O)C1=NC=C(C=C1)Cl