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Glutaric acid, di(2-(2-methoxyethyl)hexyl) ester
SpectraBase Compound ID L3RURFUdCXx
InChI InChI=1S/C23H44O6/c1-5-7-10-20(14-16-26-3)18-28-22(24)12-9-13-23(25)29-19-21(11-8-6-2)15-17-27-4/h20-21H,5-19H2,1-4H3
InChIKey WWGWOAJJOXWCCE-UHFFFAOYSA-N
Mol Weight 416.6 g/mol
Molecular Formula C23H44O6
Exact Mass 416.313789 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID F2nI0ICVpY7
Name Glutaric acid, di(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 416.313789131 u
Formula C23H44O6
InChI InChI=1S/C23H44O6/c1-5-7-10-20(14-16-26-3)18-28-22(24)12-9-13-23(25)29-19-21(11-8-6-2)15-17-27-4/h20-21H,5-19H2,1-4H3
InChIKey WWGWOAJJOXWCCE-UHFFFAOYSA-N
Molecular Weight 416.599 g/mol
SMILES COCCC(CCCC)COC(CCCC(OCC(CCCC)CCOC)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.988452