| SpectraBase Spectrum ID |
AoToFDY3aXU |
| Name |
5'-Hydroxy-[m-terphenyl]-4',6'-dicarboxylic acid, dimethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
362.115423675 u |
| Formula |
C22H18O5 |
| InChI |
InChI=1S/C22H18O5/c1-26-21(24)18-16(14-9-5-3-6-10-14)13-17(15-11-7-4-8-12-15)19(20(18)23)22(25)27-2/h3-13,23H,1-2H3 |
| InChIKey |
GEJSQNTZMJMETN-UHFFFAOYSA-N |
| Molecular Weight |
362.381 g/mol |
| SMILES |
OC=1C(=C(C=C(C1C(OC)=O)C=1C=CC=CC1)C=1C=CC=CC1)C(OC)=O |
| Spectrum/Structure Validation Score (Raman) |
0.957863 |
![5'-Hydroxy-[m-terphenyl]-4',6'-dicarboxylic acid, dimethyl ester](/api/spectrum/AoToFDY3aXU/structure.png?h=300&w=458 "5'-Hydroxy-[m-terphenyl]-4',6'-dicarboxylic acid, dimethyl ester")
