| SpectraBase Compound ID | Dsshsd7qDU4 |
|---|---|
| InChI | InChI=1S/C12H6Cl4O2/c13-7-1-5(17)2-8(14)11(7)12-9(15)3-6(18)4-10(12)16/h1-4,17-18H |
| InChIKey | CUBQDFRSSGBHPM-UHFFFAOYSA-N |
| Mol Weight | 324.0 g/mol |
| Molecular Formula | C12H6Cl4O2 |
| Exact Mass | 321.91219 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 3GJSoldtqY5 |
|---|---|
| Name | 2,2',6,6'-Tetrachloro-4,4'-biphenyldiol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 321.912190231 u |
| Formula | C12H6Cl4O2 |
| InChI | InChI=1S/C12H6Cl4O2/c13-7-1-5(17)2-8(14)11(7)12-9(15)3-6(18)4-10(12)16/h1-4,17-18H |
| InChIKey | CUBQDFRSSGBHPM-UHFFFAOYSA-N |
| SMILES | OC1=CC(=C(C=2C(=CC(=CC2Cl)O)Cl)C(=C1)Cl)Cl |
| Spectrum/Structure Validation Score (Raman) | 0.859474 |