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Benzoic acid, 4-[3-(3,4-dimethoxyphenyl)acryloylamino]-, pentyl ester
SpectraBase Compound ID ByRF1ePCMdR
InChI InChI=1S/C23H27NO5/c1-4-5-6-15-29-23(26)18-9-11-19(12-10-18)24-22(25)14-8-17-7-13-20(27-2)21(16-17)28-3/h7-14,16H,4-6,15H2,1-3H3,(H,24,25)/b14-8+
InChIKey CGSKQEAFBZYXNV-RIYZIHGNSA-N
Mol Weight 397.47 g/mol
Molecular Formula C23H27NO5
Exact Mass 397.188923 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5nYNK2qrqkm
Name Benzoic acid, 4-[3-(3,4-dimethoxyphenyl)acryloylamino]-, pentyl ester
Comments Computed using HOSE algorithm
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Exact Mass 397.188922968 u
Formula C23H27NO5
InChI InChI=1S/C23H27NO5/c1-4-5-6-15-29-23(26)18-9-11-19(12-10-18)24-22(25)14-8-17-7-13-20(27-2)21(16-17)28-3/h7-14,16H,4-6,15H2,1-3H3,(H,24,25)/b14-8+
InChIKey CGSKQEAFBZYXNV-RIYZIHGNSA-N
Molecular Weight 397.471 g/mol
SMILES C1=C(C=C(C(=C1)OC)OC)\C=C\C(NC1=CC=C(C=C1)C(OCCCCC)=O)=O