| SpectraBase Compound ID | JLySh7Ha8Yf |
|---|---|
| InChI | InChI=1S/C6H5Cl2NO/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H,9H2 |
| InChIKey | WASQBNCGNUTVNI-UHFFFAOYSA-N |
| Mol Weight | 178.02 g/mol |
| Molecular Formula | C6H5Cl2NO |
| Exact Mass | 176.974819 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | F5FXB1lGTqk |
|---|---|
| Name | 2-Amino-4,6-dichlorophenol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.974819184 u |
| Formula | C6H5Cl2NO |
| InChI | InChI=1S/C6H5Cl2NO/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H,9H2 |
| InChIKey | WASQBNCGNUTVNI-UHFFFAOYSA-N |
| Molecular Weight | 178.018 g/mol |
| SMILES | C1(=C(C(Cl)=CC(=C1)Cl)O)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.979824 |