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4-Fluorobenzoic acid, 2-phenylethyl ester

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

4-Fluorobenzoic acid, 2-phenylethyl ester
SpectraBase Compound ID E7xnrrNPqGN
InChI InChI=1S/C15H13FO2/c16-14-8-6-13(7-9-14)15(17)18-11-10-12-4-2-1-3-5-12/h1-9H,10-11H2
InChIKey VZHMLLIGPIYUBK-UHFFFAOYSA-N
Mol Weight 244.27 g/mol
Molecular Formula C15H13FO2
Exact Mass 244.089958 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID J71RviV08bj
Name 4-Fluorobenzoic acid, 2-phenylethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 244.089957820 u
Formula C15H13FO2
InChI InChI=1S/C15H13FO2/c16-14-8-6-13(7-9-14)15(17)18-11-10-12-4-2-1-3-5-12/h1-9H,10-11H2
InChIKey VZHMLLIGPIYUBK-UHFFFAOYSA-N
Molecular Weight 244.265 g/mol
SMILES C1=CC=CC=C1CCOC(=O)C=1C=CC(F)=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.912347