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2-Fluorobenzoic acid, 4-methoxyphenyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

2-Fluorobenzoic acid, 4-methoxyphenyl ester
SpectraBase Compound ID DJrWl8tTvUy
InChI InChI=1S/C14H11FO3/c1-17-10-6-8-11(9-7-10)18-14(16)12-4-2-3-5-13(12)15/h2-9H,1H3
InChIKey KBQRWXAYLVJHCC-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 84A33mYbRVT
Name 2-Fluorobenzoic acid, 4-methoxyphenyl 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/c1-17-10-6-8-11(9-7-10)18-14(16)12-4-2-3-5-13(12)15/h2-9H,1H3
InChIKey KBQRWXAYLVJHCC-UHFFFAOYSA-N
Molecular Weight 246.237 g/mol
SMILES C1=CC=C(C(=C1)C(OC1=CC=C(OC)C=C1)=O)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.846043