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4-[(3-methoxyphenoxy)methyl]-N-(2-thienylmethyl)benzamide
SpectraBase Compound ID DDRBNME21vw
InChI InChI=1S/C20H19NO3S/c1-23-17-4-2-5-18(12-17)24-14-15-7-9-16(10-8-15)20(22)21-13-19-6-3-11-25-19/h2-12H,13-14H2,1H3,(H,21,22)
InChIKey INEDNIVMJJYBHJ-UHFFFAOYSA-N
Mol Weight 353.44 g/mol
Molecular Formula C20H19NO3S
Exact Mass 353.108565 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4OuKICpzNPs
Name 4-[(3-Methoxyphenoxy)methyl]-N-(2-thienylmethyl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 353.108564647 u
Formula C20H19NO3S
InChI InChI=1S/C20H19NO3S/c1-23-17-4-2-5-18(12-17)24-14-15-7-9-16(10-8-15)20(22)21-13-19-6-3-11-25-19/h2-12H,13-14H2,1H3,(H,21,22)
InChIKey INEDNIVMJJYBHJ-UHFFFAOYSA-N
Molecular Weight 353.436 g/mol
SMILES N(CC=1SC=CC1)C(C1=CC=C(C=C1)COC1=CC(OC)=CC=C1)=O