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4-(2,6-dichlorobenzyl)oxy-3-methoxy-N-(3-pyridyl)benzamide
SpectraBase Compound ID IamYPJNiWTL
InChI InChI=1S/C20H16Cl2N2O3/c1-26-19-10-13(20(25)24-14-4-3-9-23-11-14)7-8-18(19)27-12-15-16(21)5-2-6-17(15)22/h2-11H,12H2,1H3,(H,24,25)
InChIKey ZIDLYENKIGUDJF-UHFFFAOYSA-N
Mol Weight 403.27 g/mol
Molecular Formula C20H16Cl2N2O3
Exact Mass 402.053798 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HlctyVCCIXK
Name 4-(2,6-Dichlorobenzyl)oxy-3-methoxy-N-(3-pyridyl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 402.053797780 u
Formula C20H16Cl2N2O3
InChI InChI=1S/C20H16Cl2N2O3/c1-26-19-10-13(20(25)24-14-4-3-9-23-11-14)7-8-18(19)27-12-15-16(21)5-2-6-17(15)22/h2-11H,12H2,1H3,(H,24,25)
InChIKey ZIDLYENKIGUDJF-UHFFFAOYSA-N
Molecular Weight 403.265 g/mol
SMILES C=1(COC=2C(=CC(C(NC=3C=NC=CC3)=O)=CC2)OC)C(Cl)=CC=CC1Cl