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Fumaric acid, butyl 2-methoxyethyl ester

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

Fumaric acid, butyl 2-methoxyethyl ester
SpectraBase Compound ID 4YpVx7lSCWK
InChI InChI=1S/C11H18O5/c1-3-4-7-15-10(12)5-6-11(13)16-9-8-14-2/h5-6H,3-4,7-9H2,1-2H3/b6-5+
InChIKey GDBVZFPCLJQFDO-AATRIKPKSA-N
Mol Weight 230.26 g/mol
Molecular Formula C11H18O5
Exact Mass 230.115424 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID A8KdrMU7pkk
Name Fumaric acid, butyl 2-methoxyethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 230.115423675 u
Formula C11H18O5
InChI InChI=1S/C11H18O5/c1-3-4-7-15-10(12)5-6-11(13)16-9-8-14-2/h5-6H,3-4,7-9H2,1-2H3/b6-5+
InChIKey GDBVZFPCLJQFDO-AATRIKPKSA-N
Molecular Weight 230.260 g/mol
SMILES CCCCOC(\C=C\C(OCCOC)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.948102