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Phthalic acid, 3,5-difluorophenyl phenyl ester

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

Phthalic acid, 3,5-difluorophenyl phenyl ester
SpectraBase Compound ID GJpupa7rN5U
InChI InChI=1S/C20H12F2O4/c21-13-10-14(22)12-16(11-13)26-20(24)18-9-5-4-8-17(18)19(23)25-15-6-2-1-3-7-15/h1-12H
InChIKey KMULRXRSLXOACN-UHFFFAOYSA-N
Mol Weight 354.31 g/mol
Molecular Formula C20H12F2O4
Exact Mass 354.070365 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ctSPp2k7fT
Name Phthalic acid, 3,5-difluorophenyl phenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 354.070365188 u
Formula C20H12F2O4
InChI InChI=1S/C20H12F2O4/c21-13-10-14(22)12-16(11-13)26-20(24)18-9-5-4-8-17(18)19(23)25-15-6-2-1-3-7-15/h1-12H
InChIKey KMULRXRSLXOACN-UHFFFAOYSA-N
Molecular Weight 354.309 g/mol
SMILES C1(=C(C=CC=C1)C(OC1=CC(=CC(=C1)F)F)=O)C(OC1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.924082