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Glutaric acid, isobutyl 4-methylbenzyl ester

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

Glutaric acid, isobutyl 4-methylbenzyl ester
SpectraBase Compound ID EyFdpE3cqbd
InChI InChI=1S/C17H24O4/c1-13(2)11-20-16(18)5-4-6-17(19)21-12-15-9-7-14(3)8-10-15/h7-10,13H,4-6,11-12H2,1-3H3
InChIKey GAPQYARLIBOHGY-UHFFFAOYSA-N
Mol Weight 292.38 g/mol
Molecular Formula C17H24O4
Exact Mass 292.167459 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID kMHHjhroLR
Name Glutaric acid, isobutyl 4-methylbenzyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 292.167459249 u
Formula C17H24O4
InChI InChI=1S/C17H24O4/c1-13(2)11-20-16(18)5-4-6-17(19)21-12-15-9-7-14(3)8-10-15/h7-10,13H,4-6,11-12H2,1-3H3
InChIKey GAPQYARLIBOHGY-UHFFFAOYSA-N
SMILES C(OCC=1C=CC(=CC1)C)(=O)CCCC(OCC(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.870005