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3-Phenylpropionic acid, 2-(2,3-dimethoxyphenyl)-5-methoxy-, ethyl ester
SpectraBase Compound ID 961qnD1ZAN2
InChI InChI=1S/C20H24O5/c1-5-25-19(21)12-9-14-13-15(22-2)10-11-16(14)17-7-6-8-18(23-3)20(17)24-4/h6-8,10-11,13H,5,9,12H2,1-4H3
InChIKey GIHJIKBXGSQTCO-UHFFFAOYSA-N
Mol Weight 344.41 g/mol
Molecular Formula C20H24O5
Exact Mass 344.162374 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F2FThdwNJS6
Name 3-Phenylpropionic acid, 2-(2,3-dimethoxyphenyl)-5-methoxy-, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 344.162373868 u
Formula C20H24O5
InChI InChI=1S/C20H24O5/c1-5-25-19(21)12-9-14-13-15(22-2)10-11-16(14)17-7-6-8-18(23-3)20(17)24-4/h6-8,10-11,13H,5,9,12H2,1-4H3
InChIKey GIHJIKBXGSQTCO-UHFFFAOYSA-N
Molecular Weight 344.407 g/mol
SMILES C1=C(C(=CC=C1OC)C1=CC=CC(=C1OC)OC)CCC(OCC)=O