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3-Methoxybenzoic acid, 2-fluorophenyl ester

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

3-Methoxybenzoic acid, 2-fluorophenyl ester
SpectraBase Compound ID GnjFtHLIzid
InChI InChI=1S/C14H11FO3/c1-17-11-6-4-5-10(9-11)14(16)18-13-8-3-2-7-12(13)15/h2-9H,1H3
InChIKey LJYGNMQDTGFVMB-UHFFFAOYSA-N
Mol Weight 246.24 g/mol
Molecular Formula C14H11FO3
Exact Mass 246.069222 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7aLNDt1AtKN
Name 3-Methoxybenzoic acid, 2-fluorophenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 246.069222374 u
Formula C14H11FO3
InChI InChI=1S/C14H11FO3/c1-17-11-6-4-5-10(9-11)14(16)18-13-8-3-2-7-12(13)15/h2-9H,1H3
InChIKey LJYGNMQDTGFVMB-UHFFFAOYSA-N
Molecular Weight 246.237 g/mol
SMILES C1(=CC=CC(=C1)OC)C(OC1=C(C=CC=C1)F)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.94923