| SpectraBase Compound ID | FApGnL6ut7u |
|---|---|
| InChI | InChI=1S/C12H9Cl2NO/c13-10-2-1-3-11(14)12(10)16-9-6-4-8(15)5-7-9/h1-7H,15H2 |
| InChIKey | ZORVAFDYGLBTEI-UHFFFAOYSA-N |
| Mol Weight | 254.12 g/mol |
| Molecular Formula | C12H9Cl2NO |
| Exact Mass | 253.006119 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | DldNIF0sh28 |
|---|---|
| Name | Benzenamine, 4-(2,6-dichlorophenoxy)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 253.006119313 u |
| Formula | C12H9Cl2NO |
| InChI | InChI=1S/C12H9Cl2NO/c13-10-2-1-3-11(14)12(10)16-9-6-4-8(15)5-7-9/h1-7H,15H2 |
| InChIKey | ZORVAFDYGLBTEI-UHFFFAOYSA-N |
| Molecular Weight | 254.116 g/mol |
| SMILES | NC1=CC=C(OC2=C(C=CC=C2Cl)Cl)C=C1 |
| Spectrum/Structure Validation Score (Raman) | 0.916613 |