| SpectraBase Compound ID | 5oehOLyLoE1 |
|---|---|
| InChI | InChI=1S/C9H9Cl2NO2/c1-2-14-9(13)12-6-3-4-7(10)8(11)5-6/h3-5H,2H2,1H3,(H,12,13) |
| InChIKey | AOVLXBXJFYNQAZ-UHFFFAOYSA-N |
| Mol Weight | 234.08 g/mol |
| Molecular Formula | C9H9Cl2NO2 |
| Exact Mass | 233.001034 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | FqI2gUoUKvF |
|---|---|
| Name | 3,4-Dichlorocarbanilic acid, ethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 233.001033932 u |
| Formula | C9H9Cl2NO2 |
| InChI | InChI=1S/C9H9Cl2NO2/c1-2-14-9(13)12-6-3-4-7(10)8(11)5-6/h3-5H,2H2,1H3,(H,12,13) |
| InChIKey | AOVLXBXJFYNQAZ-UHFFFAOYSA-N |
| SMILES | N(C1=CC=C(C(=C1)Cl)Cl)C(OCC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.791221 |