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2-Hydroxy-2',3',5,5',6'-pentachlorobiphenyl

View entire compound with spectra: 1 FTIR

2-Hydroxy-2',3',5,5',6'-pentachlorobiphenyl
SpectraBase Compound ID 9HWj4HRZyyk
InChI InChI=1S/C12H5Cl5O/c13-5-1-2-9(18)6(3-5)10-11(16)7(14)4-8(15)12(10)17/h1-4,18H
InChIKey FSNNNNHWVBMUBX-UHFFFAOYSA-N
Mol Weight 342.4 g/mol
Molecular Formula C12H5Cl5O
Exact Mass 339.878303 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3Xccj1fKlt7
Name 2-Hydroxy-2',3',5,5',6'-pentachlorobiphenyl
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 339.878303280 u
Formula C12H5Cl5O
InChI InChI=1S/C12H5Cl5O/c13-5-1-2-9(18)6(3-5)10-11(16)7(14)4-8(15)12(10)17/h1-4,18H
InChIKey FSNNNNHWVBMUBX-UHFFFAOYSA-N
Molecular Weight 342.436 g/mol
SMILES C1(C2=C(C(=CC(=C2Cl)Cl)Cl)Cl)=C(C=CC(=C1)Cl)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.9088