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2-Hydroxy-2',5,5'-trichlorobiphenyl, methyl ether

View entire compound with spectra: 1 NMR, and 1 FTIR

2-Hydroxy-2',5,5'-trichlorobiphenyl, methyl ether
SpectraBase Compound ID HPg0O6MOxFj
InChI InChI=1S/C13H9Cl3O/c1-17-13-5-3-9(15)7-11(13)10-6-8(14)2-4-12(10)16/h2-7H,1H3
InChIKey ZHHKYYMXGVXDJX-UHFFFAOYSA-N
Mol Weight 287.57 g/mol
Molecular Formula C13H9Cl3O
Exact Mass 285.971898 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5Ovol50QLgO
Name 2-Hydroxy-2',5,5'-trichlorobiphenyl, methyl ether
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 285.971898009 u
Formula C13H9Cl3O
InChI InChI=1S/C13H9Cl3O/c1-17-13-5-3-9(15)7-11(13)10-6-8(14)2-4-12(10)16/h2-7H,1H3
InChIKey ZHHKYYMXGVXDJX-UHFFFAOYSA-N
Molecular Weight 287.573 g/mol
SMILES C1(C2=C(C=CC(=C2)Cl)Cl)=C(C=CC(=C1)Cl)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.865975