| SpectraBase Compound ID | EuzPIpO9DGe |
|---|---|
| InChI | InChI=1S/C9H7ClN2O/c10-5-9(13)12-8-3-1-7(6-11)2-4-8/h1-4H,5H2,(H,12,13) |
| InChIKey | YEIVRXRLRGZADN-UHFFFAOYSA-N |
| Mol Weight | 194.62 g/mol |
| Molecular Formula | C9H7ClN2O |
| Exact Mass | 194.024691 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2gcTD3FWxW6 |
|---|---|
| Name | 2-Chloro-N-(4-cyanophenyl)acetamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.024690552 u |
| Formula | C9H7ClN2O |
| InChI | InChI=1S/C9H7ClN2O/c10-5-9(13)12-8-3-1-7(6-11)2-4-8/h1-4H,5H2,(H,12,13) |
| InChIKey | YEIVRXRLRGZADN-UHFFFAOYSA-N |
| Molecular Weight | 194.621 g/mol |
| SMILES | C(Cl)C(=O)NC1=CC=C(C=C1)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94851 |