| SpectraBase Compound ID | C0GhU2DcvHu |
|---|---|
| InChI | InChI=1S/C9H10ClNO/c1-7(12)11-6-8-4-2-3-5-9(8)10/h2-5H,6H2,1H3,(H,11,12) |
| InChIKey | TZBRNIWZOAPBHV-UHFFFAOYSA-N |
| Mol Weight | 183.64 g/mol |
| Molecular Formula | C9H10ClNO |
| Exact Mass | 183.045092 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5eIWMVCSMlE |
|---|---|
| Name | N-(2-Chlorobenzyl)acetamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 183.045091645 u |
| Formula | C9H10ClNO |
| InChI | InChI=1S/C9H10ClNO/c1-7(12)11-6-8-4-2-3-5-9(8)10/h2-5H,6H2,1H3,(H,11,12) |
| InChIKey | TZBRNIWZOAPBHV-UHFFFAOYSA-N |
| Molecular Weight | 183.638 g/mol |
| SMILES | C1(CNC(=O)C)=C(Cl)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.916496 |