| SpectraBase Compound ID | KFoN6arQiYC |
|---|---|
| InChI | InChI=1S/C13H9Cl2NO2/c14-9-5-7-10(8-6-9)18-13(17)16-12-4-2-1-3-11(12)15/h1-8H,(H,16,17) |
| InChIKey | FMLPKRCHAIOBTD-UHFFFAOYSA-N |
| Mol Weight | 282.13 g/mol |
| Molecular Formula | C13H9Cl2NO2 |
| Exact Mass | 281.001034 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 3ThHitncw6B |
|---|---|
| Name | o-Chlorocarbanilic acid, p-chlorophenyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.001033932 u |
| Formula | C13H9Cl2NO2 |
| InChI | InChI=1S/C13H9Cl2NO2/c14-9-5-7-10(8-6-9)18-13(17)16-12-4-2-1-3-11(12)15/h1-8H,(H,16,17) |
| InChIKey | FMLPKRCHAIOBTD-UHFFFAOYSA-N |
| SMILES | N(C1=CC=CC=C1Cl)C(OC=1C=CC(=CC1)Cl)=O |
| Spectrum/Structure Validation Score (Raman) | 0.915137 |