| SpectraBase Compound ID | AQkYswfJe52 |
|---|---|
| InChI | InChI=1S/C15H15ClN2O/c1-10-5-3-6-11(2)14(10)18-15(19)17-13-8-4-7-12(16)9-13/h3-9H,1-2H3,(H2,17,18,19) |
| InChIKey | JREMWQIUPFESRR-UHFFFAOYSA-N |
| Mol Weight | 274.75 g/mol |
| Molecular Formula | C15H15ClN2O |
| Exact Mass | 274.087291 g/mol |
| SpectraBase Spectrum ID | 11dUxKshLX3 |
|---|---|
| Name | 3'-Chloro-2,6-dimethylcarbanilide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.087290810 u |
| Formula | C15H15ClN2O |
| InChI | InChI=1S/C15H15ClN2O/c1-10-5-3-6-11(2)14(10)18-15(19)17-13-8-4-7-12(16)9-13/h3-9H,1-2H3,(H2,17,18,19) |
| InChIKey | JREMWQIUPFESRR-UHFFFAOYSA-N |
| SMILES | N(C1=CC=CC(=C1)Cl)C(NC=1C(=CC=CC1C)C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.761628 |