| SpectraBase Spectrum ID |
231TGjiygjb |
| Name |
4-[3-(4-Carboxy-2-methoxy-phenoxy)propoxy]-3-methoxy-benzoic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
376.115817596 u |
| Formula |
C19H20O8 |
| InChI |
InChI=1S/C19H20O8/c1-24-16-10-12(18(20)21)4-6-14(16)26-8-3-9-27-15-7-5-13(19(22)23)11-17(15)25-2/h4-7,10-11H,3,8-9H2,1-2H3,(H,20,21)(H,22,23) |
| InChIKey |
ASLLOEOFFFNAHP-UHFFFAOYSA-N |
| Molecular Weight |
376.361 g/mol |
| SMILES |
C(C=1C=C(OC)C(=CC1)OCCCOC=1C(=CC(C(=O)O)=CC1)OC)(=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913873 |
![4-[3-(4-Carboxy-2-methoxy-phenoxy)propoxy]-3-methoxy-benzoic acid](/api/spectrum/231TGjiygjb/structure.png?h=300&w=458 "4-[3-(4-Carboxy-2-methoxy-phenoxy)propoxy]-3-methoxy-benzoic acid")
