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Maleic acid dibutyl ester

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

Maleic acid dibutyl ester
SpectraBase Compound ID DnV1qb9JnU0
InChI InChI=1S/C13H22O4/c1-3-5-7-11-17-13(15)9-8-12(14)16-10-6-4-2/h8-9H,3-7,10-11H2,1-2H3/b9-8-
InChIKey FMRYGXQEAOCESG-HJWRWDBZSA-N
Mol Weight 242.31 g/mol
Molecular Formula C13H22O4
Exact Mass 242.151809 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID KniO2bLmtZA
Name Maleic acid, dibutyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 242.151809184 u
Formula C13H22O4
InChI InChI=1S/C13H22O4/c1-3-5-7-11-17-13(15)9-8-12(14)16-10-6-4-2/h8-9H,3-7,10-11H2,1-2H3/b9-8-
InChIKey FMRYGXQEAOCESG-HJWRWDBZSA-N
Molecular Weight 242.315 g/mol
Nominal Mass 242 u
SMILES CCCCCOC(\C=C/C(OCCCC)=O)=O
Spectrum/Structure Validation Score (Raman) 0.992979