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Adipic acid, isobutyl 2-methoxyethyl ester

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

Adipic acid, isobutyl 2-methoxyethyl ester
SpectraBase Compound ID 9mM0H8ztvAU
InChI InChI=1S/C13H24O5/c1-11(2)10-18-13(15)7-5-4-6-12(14)17-9-8-16-3/h11H,4-10H2,1-3H3
InChIKey UOXCFPYKPQLFHB-UHFFFAOYSA-N
Mol Weight 260.33 g/mol
Molecular Formula C13H24O5
Exact Mass 260.162374 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2ZwVU2J9OEE
Name Adipic acid, isobutyl 2-methoxyethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 260.162373868 u
Formula C13H24O5
InChI InChI=1S/C13H24O5/c1-11(2)10-18-13(15)7-5-4-6-12(14)17-9-8-16-3/h11H,4-10H2,1-3H3
InChIKey UOXCFPYKPQLFHB-UHFFFAOYSA-N
Molecular Weight 260.330 g/mol
SMILES C(CCCCC(=O)OCCOC)(OCC(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.912099