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3-(Phenoxymethyl)benzoic acid, methyl ester

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

3-(Phenoxymethyl)benzoic acid, methyl ester
SpectraBase Compound ID 7ADI5XZJliN
InChI InChI=1S/C15H14O3/c1-17-15(16)13-7-5-6-12(10-13)11-18-14-8-3-2-4-9-14/h2-10H,11H2,1H3
InChIKey NLAVGFSXWNJDCE-UHFFFAOYSA-N
Mol Weight 242.27 g/mol
Molecular Formula C15H14O3
Exact Mass 242.094294 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7sEUj0TD4HE
Name 3-(Phenoxymethyl)benzoic acid, methyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 242.094294308 u
Formula C15H14O3
InChI InChI=1S/C15H14O3/c1-17-15(16)13-7-5-6-12(10-13)11-18-14-8-3-2-4-9-14/h2-10H,11H2,1H3
InChIKey NLAVGFSXWNJDCE-UHFFFAOYSA-N
Molecular Weight 242.274 g/mol
SMILES C(OC1=CC=CC=C1)C1=CC(=CC=C1)C(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.942588