| SpectraBase Spectrum ID |
C9mpeivvQgg |
| Name |
o-(p-Chlorophenoxy)benzoic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
248.024021847 u |
| Formula |
C13H9ClO3 |
| InChI |
InChI=1S/C13H9ClO3/c14-9-5-7-10(8-6-9)17-12-4-2-1-3-11(12)13(15)16/h1-8H,(H,15,16) |
| InChIKey |
KPENLTXCDFOSOO-UHFFFAOYSA-N |
| Molecular Weight |
248.665 g/mol |
| SMILES |
C1=CC(C(=O)O)=C(C=C1)OC1=CC=C(C=C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947208 |
