| SpectraBase Compound ID | 6olkl0QsudR |
|---|---|
| InChI | InChI=1S/C5H7ClN2O/c6-4-5(9)8-3-1-2-7/h1,3-4H2,(H,8,9) |
| InChIKey | WECIKJKLCDCIMY-UHFFFAOYSA-N |
| Mol Weight | 146.58 g/mol |
| Molecular Formula | C5H7ClN2O |
| Exact Mass | 146.024691 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9V5Uio8KP7u |
|---|---|
| Name | Acetamide, 2-chloro-N-(2-cyanoethyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 146.024690552 u |
| Formula | C5H7ClN2O |
| InChI | InChI=1S/C5H7ClN2O/c6-4-5(9)8-3-1-2-7/h1,3-4H2,(H,8,9) |
| InChIKey | WECIKJKLCDCIMY-UHFFFAOYSA-N |
| SMILES | C(NCCC#N)(CCl)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.979489 |