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4-Methoxybenzoic acid, 2-ethoxyethyl ester

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

4-Methoxybenzoic acid, 2-ethoxyethyl ester
SpectraBase Compound ID Al5MddeZGPj
InChI InChI=1S/C12H16O4/c1-3-15-8-9-16-12(13)10-4-6-11(14-2)7-5-10/h4-7H,3,8-9H2,1-2H3
InChIKey CEGXLBKWCOAQKL-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID K4MXjuSrtkz
Name 4-Methoxybenzoic acid, 2-ethoxyethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 224.104858991 u
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-3-15-8-9-16-12(13)10-4-6-11(14-2)7-5-10/h4-7H,3,8-9H2,1-2H3
InChIKey CEGXLBKWCOAQKL-UHFFFAOYSA-N
Molecular Weight 224.256 g/mol
SMILES C(C1=CC=C(C=C1)OC)(=O)OCCOCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.959506