For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-Phenylpropionic acid, 5-methoxy-2-[3,4-dimethoxyphenyl]-
SpectraBase Compound ID 9ZujMC5uPFq
InChI InChI=1S/C18H20O5/c1-21-14-6-7-15(12(10-14)5-9-18(19)20)13-4-8-16(22-2)17(11-13)23-3/h4,6-8,10-11H,5,9H2,1-3H3,(H,19,20)
InChIKey UBWJWORAGKSOCG-UHFFFAOYSA-N
Mol Weight 316.35 g/mol
Molecular Formula C18H20O5
Exact Mass 316.131074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BWb20qrTFEo
Name 3-Phenylpropionic acid, 5-methoxy-2-[3,4-dimethoxyphenyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 316.131073739 u
Formula C18H20O5
InChI InChI=1S/C18H20O5/c1-21-14-6-7-15(12(10-14)5-9-18(19)20)13-4-8-16(22-2)17(11-13)23-3/h4,6-8,10-11H,5,9H2,1-3H3,(H,19,20)
InChIKey UBWJWORAGKSOCG-UHFFFAOYSA-N
Molecular Weight 316.353 g/mol
SMILES C1=CC(=C(C=C1C1=CC=C(C=C1CCC(O)=O)OC)OC)OC