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N-(2,5-dichlorophenyl)-5-[(4-propylphenoxy)methyl]-2-furamide
SpectraBase Compound ID 11dtWglAWqM
InChI InChI=1S/C21H19Cl2NO3/c1-2-3-14-4-7-16(8-5-14)26-13-17-9-11-20(27-17)21(25)24-19-12-15(22)6-10-18(19)23/h4-12H,2-3,13H2,1H3,(H,24,25)
InChIKey CPFGGIDXMTXQMU-UHFFFAOYSA-N
Mol Weight 404.29 g/mol
Molecular Formula C21H19Cl2NO3
Exact Mass 403.074199 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ynxLf9ILcg
Name N-(2,5-Dichlorophenyl)-5-[(4-propylphenoxy)methyl]-2-furamide
Comments Computed using HOSE algorithm
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Exact Mass 403.074198873 u
Formula C21H19Cl2NO3
InChI InChI=1S/C21H19Cl2NO3/c1-2-3-14-4-7-16(8-5-14)26-13-17-9-11-20(27-17)21(25)24-19-12-15(22)6-10-18(19)23/h4-12H,2-3,13H2,1H3,(H,24,25)
InChIKey CPFGGIDXMTXQMU-UHFFFAOYSA-N
Molecular Weight 404.293 g/mol
SMILES N(C(C=1OC(COC2=CC=C(C=C2)CCC)=CC1)=O)C=1C=C(Cl)C=CC1Cl