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Propionic acid, 3-(3,4-dimethoxybenzoylamino)-3-(4-ethoxyphenyl)-, ethyl ester
SpectraBase Compound ID HGVjdOjTZdg
InChI InChI=1S/C22H27NO6/c1-5-28-17-10-7-15(8-11-17)18(14-21(24)29-6-2)23-22(25)16-9-12-19(26-3)20(13-16)27-4/h7-13,18H,5-6,14H2,1-4H3,(H,23,25)
InChIKey CQGWGZLWANSKTH-UHFFFAOYSA-N
Mol Weight 401.46 g/mol
Molecular Formula C22H27NO6
Exact Mass 401.183838 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6J5PrdRkhsv
Name Propionic acid, 3-(3,4-dimethoxybenzoylamino)-3-(4-ethoxyphenyl)-, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 401.183837587 u
Formula C22H27NO6
InChI InChI=1S/C22H27NO6/c1-5-28-17-10-7-15(8-11-17)18(14-21(24)29-6-2)23-22(25)16-9-12-19(26-3)20(13-16)27-4/h7-13,18H,5-6,14H2,1-4H3,(H,23,25)
InChIKey CQGWGZLWANSKTH-UHFFFAOYSA-N
Molecular Weight 401.459 g/mol
SMILES C1=CC(=CC=C1C(CC(OCC)=O)NC(=O)C1=CC=C(C(=C1)OC)OC)OCC