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2,6-Difluoro-3-methylbenzoic acid, 4-chlorophenyl ester

View entire compound with spectra: 1 FTIR

2,6-Difluoro-3-methylbenzoic acid, 4-chlorophenyl ester
SpectraBase Compound ID 7htrrxgprDh
InChI InChI=1S/C14H9ClF2O2/c1-8-2-7-11(16)12(13(8)17)14(18)19-10-5-3-9(15)4-6-10/h2-7H,1H3
InChIKey MZKJPBVMPYPFGX-UHFFFAOYSA-N
Mol Weight 282.67 g/mol
Molecular Formula C14H9ClF2O2
Exact Mass 282.025914 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FXP7TfNHdiB
Name 2,6-Difluoro-3-methylbenzoic acid, 4-chlorophenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 282.025913554 u
Formula C14H9ClF2O2
InChI InChI=1S/C14H9ClF2O2/c1-8-2-7-11(16)12(13(8)17)14(18)19-10-5-3-9(15)4-6-10/h2-7H,1H3
InChIKey MZKJPBVMPYPFGX-UHFFFAOYSA-N
Molecular Weight 282.674 g/mol
SMILES C1(=CC=C(C=C1)OC(C1=C(C(=CC=C1F)C)F)=O)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.941133