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5-Hydroxy-2,2',4,6'-tetrachlorobiphenyl

View entire compound with spectra: 1 FTIR

5-Hydroxy-2,2',4,6'-tetrachlorobiphenyl
SpectraBase Compound ID 48l2vEfj0bG
InChI InChI=1S/C12H6Cl4O/c13-7-2-1-3-8(14)12(7)6-4-11(17)10(16)5-9(6)15/h1-5,17H
InChIKey NXMDSCYRICVRIZ-UHFFFAOYSA-N
Mol Weight 308.0 g/mol
Molecular Formula C12H6Cl4O
Exact Mass 305.917276 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KvJp0ueXhKM
Name 5-Hydroxy-2,2',4,6'-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/c13-7-2-1-3-8(14)12(7)6-4-11(17)10(16)5-9(6)15/h1-5,17H
InChIKey NXMDSCYRICVRIZ-UHFFFAOYSA-N
Molecular Weight 307.991 g/mol
SMILES C1(C2=C(C=CC=C2Cl)Cl)=C(C=C(C(=C1)O)Cl)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.941176