SpectraBase Spectrum ID |
24FzF2OPB4p |
Name |
4,4'-Dimethoxy-biphenyl-2-carboxylic acid, methyl ester |
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/c1-18-12-6-4-11(5-7-12)14-9-8-13(19-2)10-15(14)16(17)20-3/h4-10H,1-3H3 |
InChIKey |
GIESQPOZLGLUIL-UHFFFAOYSA-N |
Molecular Weight |
272.300 g/mol |
SMILES |
C1=CC(C2=CC=C(C=C2C(OC)=O)OC)=CC=C1OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962969 |