| SpectraBase Compound ID | IW7j2Wr7kjd |
|---|---|
| InChI | InChI=1S/C5H9Cl2NO/c1-2-3-8-5(9)4(6)7/h4H,2-3H2,1H3,(H,8,9) |
| InChIKey | HGGMIQPSSPTGAO-UHFFFAOYSA-N |
| Mol Weight | 170.04 g/mol |
| Molecular Formula | C5H9Cl2NO |
| Exact Mass | 169.006119 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7mADNqRanTA |
|---|---|
| Name | 2,2-Dichloro-N-propylacetamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 169.006119313 u |
| Formula | C5H9Cl2NO |
| InChI | InChI=1S/C5H9Cl2NO/c1-2-3-8-5(9)4(6)7/h4H,2-3H2,1H3,(H,8,9) |
| InChIKey | HGGMIQPSSPTGAO-UHFFFAOYSA-N |
| SMILES | C(C(Cl)Cl)(NCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.967862 |