| SpectraBase Compound ID | 5W4Jw8sm0Yv |
|---|---|
| InChI | InChI=1S/C15H13ClO2/c1-10-3-8-14(9-11(10)2)18-15(17)12-4-6-13(16)7-5-12/h3-9H,1-2H3 |
| InChIKey | ZNWWIJMEMQDIOJ-UHFFFAOYSA-N |
| Mol Weight | 260.72 g/mol |
| Molecular Formula | C15H13ClO2 |
| Exact Mass | 260.060407 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Cu511ICIrzC |
|---|---|
| Name | 4-Chlorobenzoic acid, 3,4-dimethylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.060407357 u |
| Formula | C15H13ClO2 |
| InChI | InChI=1S/C15H13ClO2/c1-10-3-8-14(9-11(10)2)18-15(17)12-4-6-13(16)7-5-12/h3-9H,1-2H3 |
| InChIKey | ZNWWIJMEMQDIOJ-UHFFFAOYSA-N |
| Molecular Weight | 260.720 g/mol |
| SMILES | C1=CC(=CC=C1C(=O)OC=1C=C(C(C)=CC1)C)Cl |