| SpectraBase Compound ID | 6dtQQFDem6d |
|---|---|
| InChI | InChI=1S/C12H4Cl6/c13-6-1-5(2-7(14)3-6)8-4-9(15)11(17)12(18)10(8)16/h1-4H |
| InChIKey | YZKLGRAIIIGOHB-UHFFFAOYSA-N |
| Mol Weight | 360.9 g/mol |
| Molecular Formula | C12H4Cl6 |
| Exact Mass | 357.844416 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C2WmALU5YnB |
|---|---|
| Name | 2,3,3',4,5,5'-Hexachloro-1,1'-biphenyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 357.844416329 u |
| Formula | C12H4Cl6 |
| InChI | InChI=1S/C12H4Cl6/c13-6-1-5(2-7(14)3-6)8-4-9(15)11(17)12(18)10(8)16/h1-4H |
| InChIKey | YZKLGRAIIIGOHB-UHFFFAOYSA-N |
| Molecular Weight | 360.882 g/mol |
| SMILES | C1(=CC(=C(C(=C1Cl)Cl)Cl)Cl)C1=CC(=CC(=C1)Cl)Cl |