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2,6-Difluorobenzoic acid, 3,4-dichlorophenyl ester
SpectraBase Compound ID Kf3vjTdjb4H
InChI InChI=1S/C13H6Cl2F2O2/c14-8-5-4-7(6-9(8)15)19-13(18)12-10(16)2-1-3-11(12)17/h1-6H
InChIKey WTRLNMSFFKRURF-UHFFFAOYSA-N
Mol Weight 303.09 g/mol
Molecular Formula C13H6Cl2F2O2
Exact Mass 301.971291 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9l4q5ZyNqLh
Name 2,6-Difluorobenzoic acid, 3,4-dichlorophenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 301.971291157 u
Formula C13H6Cl2F2O2
InChI InChI=1S/C13H6Cl2F2O2/c14-8-5-4-7(6-9(8)15)19-13(18)12-10(16)2-1-3-11(12)17/h1-6H
InChIKey WTRLNMSFFKRURF-UHFFFAOYSA-N
Molecular Weight 303.092 g/mol
SMILES C1=CC=C(C(=C1F)C(OC1=CC(=C(C=C1)Cl)Cl)=O)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.95745