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4-[(4-chlorophenoxy)methyl]-N-(3,4-dimethylphenyl)benzamide
SpectraBase Compound ID La7xCobm4wX
InChI InChI=1S/C22H20ClNO2/c1-15-3-10-20(13-16(15)2)24-22(25)18-6-4-17(5-7-18)14-26-21-11-8-19(23)9-12-21/h3-13H,14H2,1-2H3,(H,24,25)
InChIKey POXCRUACZFDDAI-UHFFFAOYSA-N
Mol Weight 365.86 g/mol
Molecular Formula C22H20ClNO2
Exact Mass 365.118257 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AS4j7bUQUzy
Name 4-[(4-Chlorophenoxy)methyl]-N-(3,4-dimethylphenyl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 365.118256586 u
Formula C22H20ClNO2
InChI InChI=1S/C22H20ClNO2/c1-15-3-10-20(13-16(15)2)24-22(25)18-6-4-17(5-7-18)14-26-21-11-8-19(23)9-12-21/h3-13H,14H2,1-2H3,(H,24,25)
InChIKey POXCRUACZFDDAI-UHFFFAOYSA-N
Molecular Weight 365.860 g/mol
SMILES N(C(C=1C=CC(=CC1)COC=1C=CC(Cl)=CC1)=O)C=1C=C(C)C(=CC1)C