| SpectraBase Spectrum ID |
4aG5NxTOXgx |
| Name |
4-Hydroxy-2',3,5,5'-tetrachlorobiphenyl |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.917275612 u |
| Formula |
C12H6Cl4O |
| InChI |
InChI=1S/C12H6Cl4O/c13-7-1-2-9(14)8(5-7)6-3-10(15)12(17)11(16)4-6/h1-5,17H |
| InChIKey |
XKKCINSXSUTMIS-UHFFFAOYSA-N |
| Molecular Weight |
307.991 g/mol |
| SMILES |
C1(C2=C(C=CC(=C2)Cl)Cl)=CC(=C(C(=C1)Cl)O)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958579 |
