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2-Oxo-2-phenylethyl 3-(4-methoxyphenyl)-3-[(phenylacetyl)amino]propanoate
SpectraBase Compound ID 5wbx3dJFOA
InChI InChI=1S/C26H25NO5/c1-31-22-14-12-20(13-15-22)23(27-25(29)16-19-8-4-2-5-9-19)17-26(30)32-18-24(28)21-10-6-3-7-11-21/h2-15,23H,16-18H2,1H3,(H,27,29)
InChIKey UPHIIPGILDJRTG-UHFFFAOYSA-N
Mol Weight 431.49 g/mol
Molecular Formula C26H25NO5
Exact Mass 431.173273 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LRJIkqh24h
Name 2-oxo-2-Phenylethyl 3-(4-methoxyphenyl)-3-[(phenylacetyl)amino]propanoate
Comments Computed using HOSE algorithm
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Exact Mass 431.173272904 u
Formula C26H25NO5
InChI InChI=1S/C26H25NO5/c1-31-22-14-12-20(13-15-22)23(27-25(29)16-19-8-4-2-5-9-19)17-26(30)32-18-24(28)21-10-6-3-7-11-21/h2-15,23H,16-18H2,1H3,(H,27,29)
InChIKey UPHIIPGILDJRTG-UHFFFAOYSA-N
Molecular Weight 431.488 g/mol
SMILES C(C(NC(=O)CC1=CC=CC=C1)C=1C=CC(=CC1)OC)C(OCC(=O)C=1C=CC=CC1)=O