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3,3',4',5-Tetrachloro-4-hydroxybiphenyl

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

3,3',4',5-Tetrachloro-4-hydroxybiphenyl
SpectraBase Compound ID E5E3Si4c85
InChI InChI=1S/C12H6Cl4O/c13-8-2-1-6(3-9(8)14)7-4-10(15)12(17)11(16)5-7/h1-5,17H
InChIKey RQGVZEFZWFEKQR-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 K4F1ffZ94Ps
Name 3,3',4',5-Tetrachloro-4-hydroxybiphenyl
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/c13-8-2-1-6(3-9(8)14)7-4-10(15)12(17)11(16)5-7/h1-5,17H
InChIKey RQGVZEFZWFEKQR-UHFFFAOYSA-N
Molecular Weight 307.991 g/mol
SMILES C=1(C(=CC(=CC1Cl)C1=CC(Cl)=C(C=C1)Cl)Cl)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951309