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2-[(4-Fluorobenzyl)oxy]benzoic acid

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

2-[(4-Fluorobenzyl)oxy]benzoic acid
SpectraBase Compound ID Cwx2rR05sOT
InChI InChI=1S/C14H11FO3/c15-11-7-5-10(6-8-11)9-18-13-4-2-1-3-12(13)14(16)17/h1-8H,9H2,(H,16,17)
InChIKey BQYHWZTZZNBDMR-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 GUhqCQKkWLa
Name 2-[(4-Fluorobenzyl)oxy]benzoic acid
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/c15-11-7-5-10(6-8-11)9-18-13-4-2-1-3-12(13)14(16)17/h1-8H,9H2,(H,16,17)
InChIKey BQYHWZTZZNBDMR-UHFFFAOYSA-N
Molecular Weight 246.237 g/mol
SMILES C1(F)=CC=C(C=C1)COC1=C(C=CC=C1)C(=O)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.80027