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3-(4-Methoxyphenyl)-3-(p-anisoylamino)propionic acid

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-(4-Methoxyphenyl)-3-(p-anisoylamino)propionic acid
SpectraBase Compound ID FX9G8QAEd5V
InChI InChI=1S/C18H19NO5/c1-23-14-7-3-12(4-8-14)16(11-17(20)21)19-18(22)13-5-9-15(24-2)10-6-13/h3-10,16H,11H2,1-2H3,(H,19,22)(H,20,21)
InChIKey QHBHFAWXYGGLGG-UHFFFAOYSA-N
Mol Weight 329.35 g/mol
Molecular Formula C18H19NO5
Exact Mass 329.126323 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IFLzb6RoDUG
Name 3-(4-Methoxyphenyl)-3-(p-anisoylamino)propionic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.126322711 u
Formula C18H19NO5
InChI InChI=1S/C18H19NO5/c1-23-14-7-3-12(4-8-14)16(11-17(20)21)19-18(22)13-5-9-15(24-2)10-6-13/h3-10,16H,11H2,1-2H3,(H,19,22)(H,20,21)
InChIKey QHBHFAWXYGGLGG-UHFFFAOYSA-N
Molecular Weight 329.352 g/mol
SMILES C(NC(CC(=O)O)C=1C=CC(OC)=CC1)(C=1C=CC(=CC1)OC)=O