| SpectraBase Compound ID | 6zTVzMtuMih |
|---|---|
| InChI | InChI=1S/C14H12ClNO/c1-10-5-4-6-11(9-10)14(17)16-13-8-3-2-7-12(13)15/h2-9H,1H3,(H,16,17) |
| InChIKey | PJGDSKCWIKBTLJ-UHFFFAOYSA-N |
| Mol Weight | 245.71 g/mol |
| Molecular Formula | C14H12ClNO |
| Exact Mass | 245.060742 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | JXJqldVy6lE |
|---|---|
| Name | 2'-Chloro-m-toluanilide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.060741709 u |
| Formula | C14H12ClNO |
| InChI | InChI=1S/C14H12ClNO/c1-10-5-4-6-11(9-10)14(17)16-13-8-3-2-7-12(13)15/h2-9H,1H3,(H,16,17) |
| InChIKey | PJGDSKCWIKBTLJ-UHFFFAOYSA-N |
| Molecular Weight | 245.709 g/mol |
| SMILES | N(C(C1=CC=CC(=C1)C)=O)C=1C(=CC=CC1)Cl |
| Spectrum/Structure Validation Score (Raman) | 0.926156 |