SpectraBase Spectrum ID |
HuAnlLHaJAY |
Name |
[4-Methoxy-3-(2-methoxyphenyl)phenyl]acetic acid |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
272.104858991 u |
Formula |
C16H16O4 |
InChI |
InChI=1S/C16H16O4/c1-19-14-6-4-3-5-12(14)13-9-11(10-16(17)18)7-8-15(13)20-2/h3-9H,10H2,1-2H3,(H,17,18) |
InChIKey |
XYFBEVCWFCNFOM-UHFFFAOYSA-N |
Molecular Weight |
272.300 g/mol |
SMILES |
C1=C(C(C2=CC(CC(=O)O)=CC=C2OC)=CC=C1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.879966 |