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Glutaric acid, butyl 2-(2-methoxyethyl)hexyl ester

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

Glutaric acid, butyl 2-(2-methoxyethyl)hexyl ester
SpectraBase Compound ID ETJeOb1ToTC
InChI InChI=1S/C18H34O5/c1-4-6-9-16(12-14-21-3)15-23-18(20)11-8-10-17(19)22-13-7-5-2/h16H,4-15H2,1-3H3
InChIKey NGCMYTFJAXDIGM-UHFFFAOYSA-N
Mol Weight 330.5 g/mol
Molecular Formula C18H34O5
Exact Mass 330.240624 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AjfbJOXJkeK
Name Glutaric acid, butyl 2-(2-methoxyethyl)hexyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 330.240624190 u
Formula C18H34O5
InChI InChI=1S/C18H34O5/c1-4-6-9-16(12-14-21-3)15-23-18(20)11-8-10-17(19)22-13-7-5-2/h16H,4-15H2,1-3H3
InChIKey NGCMYTFJAXDIGM-UHFFFAOYSA-N
Molecular Weight 330.465 g/mol
SMILES CCCCOC(CCCC(OCC(CCCC)CCOC)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.803613