| SpectraBase Compound ID | FhqiMor84j1 |
|---|---|
| InChI | InChI=1S/C12H3Cl7/c13-4-1-5(14)9(6(15)2-4)10-11(18)7(16)3-8(17)12(10)19/h1-3H |
| InChIKey | MMTJWDQKGUNSDK-UHFFFAOYSA-N |
| Mol Weight | 395.3 g/mol |
| Molecular Formula | C12H3Cl7 |
| Exact Mass | 391.805444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5KEbyS9eaZw |
|---|---|
| Name | 2,2',3,4',5,6,6'-Heptachloro-1,1'-biphenyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 391.805443997 u |
| Formula | C12H3Cl7 |
| InChI | InChI=1S/C12H3Cl7/c13-4-1-5(14)9(6(15)2-4)10-11(18)7(16)3-8(17)12(10)19/h1-3H |
| InChIKey | MMTJWDQKGUNSDK-UHFFFAOYSA-N |
| Molecular Weight | 395.327 g/mol |
| SMILES | C1(=C(C=C(C(=C1C1=C(C=C(C=C1Cl)Cl)Cl)Cl)Cl)Cl)Cl |