| SpectraBase Spectrum ID |
KZI4FnJSd8J |
| Name |
2-Chlorobenzoic acid, 4-biphenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
308.060407357 u |
| Formula |
C19H13ClO2 |
| InChI |
InChI=1S/C19H13ClO2/c20-18-9-5-4-8-17(18)19(21)22-16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13H |
| InChIKey |
PICQCEDMAHLCPV-UHFFFAOYSA-N |
| Molecular Weight |
308.764 g/mol |
| SMILES |
C1=CC=C(C=C1)C1=CC=C(OC(C2=C(C=CC=C2)Cl)=O)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.855571 |
