| SpectraBase Compound ID | GQj7Z2AoPBT |
|---|---|
| InChI | InChI=1S/C9H9Cl2NO/c1-2-12-9(13)6-3-7(10)5-8(11)4-6/h3-5H,2H2,1H3,(H,12,13) |
| InChIKey | ZVJJAWHZUKVECT-UHFFFAOYSA-N |
| Mol Weight | 218.08 g/mol |
| Molecular Formula | C9H9Cl2NO |
| Exact Mass | 217.006119 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 18fNDFEKioU |
|---|---|
| Name | Benzamide, 3,5-dichloro-N-ethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.006119313 u |
| Formula | C9H9Cl2NO |
| InChI | InChI=1S/C9H9Cl2NO/c1-2-12-9(13)6-3-7(10)5-8(11)4-6/h3-5H,2H2,1H3,(H,12,13) |
| InChIKey | ZVJJAWHZUKVECT-UHFFFAOYSA-N |
| SMILES | N(C(C1=CC(=CC(=C1)Cl)Cl)=O)CC |
| Spectrum/Structure Validation Score (Raman) | 0.932839 |