| SpectraBase Compound ID | LGzLyzo22d |
|---|---|
| InChI | InChI=1S/C9H9Cl2NO/c1-12(9(13)8(10)11)7-5-3-2-4-6-7/h2-6,8H,1H3 |
| InChIKey | XHVCFGZWBIJJDZ-UHFFFAOYSA-N |
| Mol Weight | 218.08 g/mol |
| Molecular Formula | C9H9Cl2NO |
| Exact Mass | 217.006119 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FM5eTcR3ox6 |
|---|---|
| Name | 2,2-bis(Chloranyl)-N-methyl-N-phenyl-ethanamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.006119313 u |
| Formula | C9H9Cl2NO |
| InChI | InChI=1S/C9H9Cl2NO/c1-12(9(13)8(10)11)7-5-3-2-4-6-7/h2-6,8H,1H3 |
| InChIKey | XHVCFGZWBIJJDZ-UHFFFAOYSA-N |
| Molecular Weight | 218.083 g/mol |
| SMILES | C(C(Cl)Cl)(=O)N(C=1C=CC=CC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.87603 |