| SpectraBase Compound ID | 2XBnBfT9FI9 |
|---|---|
| InChI | InChI=1S/C9H9ClN2O/c10-6-9(13)12-11-7-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,12,13)/b11-7+ |
| InChIKey | VBRGLVUYRZOKSO-YRNVUSSQSA-N |
| Mol Weight | 196.64 g/mol |
| Molecular Formula | C9H9ClN2O |
| Exact Mass | 196.040341 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8kRExKPHqUq |
|---|---|
| Name | Benzaldehyde chloroacetylhydrazone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.040340617 u |
| Formula | C9H9ClN2O |
| InChI | InChI=1S/C9H9ClN2O/c10-6-9(13)12-11-7-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,12,13)/b11-7+ |
| InChIKey | VBRGLVUYRZOKSO-YRNVUSSQSA-N |
| Molecular Weight | 196.637 g/mol |
| SMILES | C1=C(C=CC=C1)\C=N\NC(CCl)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.961619 |