| SpectraBase Compound ID | CmJRNPzfoBG |
|---|---|
| InChI | InChI=1S/C12H9Cl2NO/c13-8-5-6-12(10(15)7-8)16-11-4-2-1-3-9(11)14/h1-7H,15H2 |
| InChIKey | PHORTNLNXNZNET-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 | 6ZYcSkUkzPY |
|---|---|
| Name | 5-Chloro-2-(o-chlorophenoxy)aniline |
| 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/c13-8-5-6-12(10(15)7-8)16-11-4-2-1-3-9(11)14/h1-7H,15H2 |
| InChIKey | PHORTNLNXNZNET-UHFFFAOYSA-N |
| Molecular Weight | 254.116 g/mol |
| SMILES | NC=1C(=CC=C(C1)Cl)OC=1C=CC=CC1Cl |
| Spectrum/Structure Validation Score (Raman) | 0.943354 |