| SpectraBase Compound ID | ISH5Yz6QnxA |
|---|---|
| InChI | InChI=1S/C12H5Cl5/c13-7-3-1-2-6(4-7)8-5-9(14)11(16)12(17)10(8)15/h1-5H |
| InChIKey | BQENMISTWGTJIJ-UHFFFAOYSA-N |
| Mol Weight | 326.4 g/mol |
| Molecular Formula | C12H5Cl5 |
| Exact Mass | 323.883389 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 51sDL4rlRYi |
|---|---|
| Name | 2,3,3',4,5-Pentachloro-1,1'-biphenyl |
| 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/c13-7-3-1-2-6(4-7)8-5-9(14)11(16)12(17)10(8)15/h1-5H |
| InChIKey | BQENMISTWGTJIJ-UHFFFAOYSA-N |
| Molecular Weight | 326.437 g/mol |
| SMILES | C1(=CC(=CC=C1)Cl)C1=CC(=C(C(=C1Cl)Cl)Cl)Cl |