| SpectraBase Compound ID | 33g4QCu6hUd |
|---|---|
| InChI | InChI=1S/C12H2Cl8/c13-4-1-3(2-5(14)7(4)15)6-8(16)10(18)12(20)11(19)9(6)17/h1-2H |
| InChIKey | VXXBCDUYUQKWCK-UHFFFAOYSA-N |
| Mol Weight | 429.8 g/mol |
| Molecular Formula | C12H2Cl8 |
| Exact Mass | 425.766472 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8aius6Gdh8i |
|---|---|
| Name | 2,3,3',4,4',5,5',6-Octachloro-1,1'-biphenyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 425.766471664 u |
| Formula | C12H2Cl8 |
| InChI | InChI=1S/C12H2Cl8/c13-4-1-3(2-5(14)7(4)15)6-8(16)10(18)12(20)11(19)9(6)17/h1-2H |
| InChIKey | VXXBCDUYUQKWCK-UHFFFAOYSA-N |
| Molecular Weight | 429.772 g/mol |
| SMILES | C1(=C(C(=C(C(=C1C1=CC(=C(C(=C1)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl |