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N-(2-chlorophenyl)-4-[(2,3,5,6-tetrafluorophenoxy)methyl]benzamide
SpectraBase Compound ID 2w52Nhl8GMZ
InChI InChI=1S/C20H12ClF4NO2/c21-13-3-1-2-4-16(13)26-20(27)12-7-5-11(6-8-12)10-28-19-17(24)14(22)9-15(23)18(19)25/h1-9H,10H2,(H,26,27)
InChIKey IFFSYWZZTIDHKA-UHFFFAOYSA-N
Mol Weight 409.77 g/mol
Molecular Formula C20H12ClF4NO2
Exact Mass 409.049269 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E0a7qHw0buM
Name N-(2-Chlorophenyl)-4-[(2,3,5,6-tetrafluorophenoxy)methyl]benzamide
Comments Computed using HOSE algorithm
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Exact Mass 409.049268980 u
Formula C20H12ClF4NO2
InChI InChI=1S/C20H12ClF4NO2/c21-13-3-1-2-4-16(13)26-20(27)12-7-5-11(6-8-12)10-28-19-17(24)14(22)9-15(23)18(19)25/h1-9H,10H2,(H,26,27)
InChIKey IFFSYWZZTIDHKA-UHFFFAOYSA-N
Molecular Weight 409.768 g/mol
SMILES N(C(C1=CC=C(COC2=C(C(F)=CC(=C2F)F)F)C=C1)=O)C1=C(Cl)C=CC=C1