| SpectraBase Compound ID | AjdU4GTvhXP |
|---|---|
| InChI | InChI=1S/C12H5Cl5/c13-7-4-2-1-3-6(7)10-11(16)8(14)5-9(15)12(10)17/h1-5H |
| InChIKey | BMXRLHMJGHJGLR-UHFFFAOYSA-N |
| Mol Weight | 326.4 g/mol |
| Molecular Formula | C12H5Cl5 |
| Exact Mass | 323.883389 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7FD6aQTe0OM |
|---|---|
| Name | 1,1'-Biphenyl, 2,2',3,5,6-pentachloro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 323.883388661 u |
| Formula | C12H5Cl5 |
| InChI | InChI=1S/C12H5Cl5/c13-7-4-2-1-3-6(7)10-11(16)8(14)5-9(15)12(10)17/h1-5H |
| InChIKey | BMXRLHMJGHJGLR-UHFFFAOYSA-N |
| Molecular Weight | 326.437 g/mol |
| SMILES | C1(=C(C(=C(C(=C1)Cl)Cl)C1=CC=CC=C1Cl)Cl)Cl |