| SpectraBase Spectrum ID |
JfuGbVCdiAB |
| Name |
Phthalic acid, 3,4-dichlorophenyl phenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
386.011264262 u |
| Formula |
C20H12Cl2O4 |
| InChI |
InChI=1S/C20H12Cl2O4/c21-17-11-10-14(12-18(17)22)26-20(24)16-9-5-4-8-15(16)19(23)25-13-6-2-1-3-7-13/h1-12H |
| InChIKey |
RWBYDEJSXZTCND-UHFFFAOYSA-N |
| Molecular Weight |
387.218 g/mol |
| SMILES |
C1(=C(C=CC=C1)C(OC1=CC=CC=C1)=O)C(OC1=CC(=C(C=C1)Cl)Cl)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.895597 |
