| SpectraBase Compound ID | 9jUkAaupaKf |
|---|---|
| InChI | InChI=1S/C8H7Cl2NO/c1-11-8(12)5-2-6(9)4-7(10)3-5/h2-4H,1H3,(H,11,12) |
| InChIKey | BICUCGPTPDFRIK-UHFFFAOYSA-N |
| Mol Weight | 204.06 g/mol |
| Molecular Formula | C8H7Cl2NO |
| Exact Mass | 202.990469 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 7innSRJq7d |
|---|---|
| Name | Benzamide, 3,5-dichloro-N-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.990469248 u |
| Formula | C8H7Cl2NO |
| InChI | InChI=1S/C8H7Cl2NO/c1-11-8(12)5-2-6(9)4-7(10)3-5/h2-4H,1H3,(H,11,12) |
| InChIKey | BICUCGPTPDFRIK-UHFFFAOYSA-N |
| Molecular Weight | 204.056 g/mol |
| SMILES | N(C(C1=CC(=CC(=C1)Cl)Cl)=O)C |
| Spectrum/Structure Validation Score (Raman) | 0.94151 |