For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Glutaric acid, isobutyl 4-methoxybenzyl ester

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

Glutaric acid, isobutyl 4-methoxybenzyl ester
SpectraBase Compound ID 7hhO0r7g1Ak
InChI InChI=1S/C17H24O5/c1-13(2)11-21-16(18)5-4-6-17(19)22-12-14-7-9-15(20-3)10-8-14/h7-10,13H,4-6,11-12H2,1-3H3
InChIKey NGIXEQXZIAUZIV-UHFFFAOYSA-N
Mol Weight 308.37 g/mol
Molecular Formula C17H24O5
Exact Mass 308.162374 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID LBl9rouSw0O
Name Glutaric acid, isobutyl 4-methoxybenzyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 308.162373868 u
Formula C17H24O5
InChI InChI=1S/C17H24O5/c1-13(2)11-21-16(18)5-4-6-17(19)22-12-14-7-9-15(20-3)10-8-14/h7-10,13H,4-6,11-12H2,1-3H3
InChIKey NGIXEQXZIAUZIV-UHFFFAOYSA-N
SMILES COC1=CC=C(COC(=O)CCCC(OCC(C)C)=O)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.865866