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Monoethyl fumarate

View entire compound with spectra: 4 NMR, 9 FTIR, 1 Raman, and 5 MS (GC)

Monoethyl fumarate
SpectraBase Compound ID 39RKSHWZgcj
InChI InChI=1S/C6H8O4/c1-2-10-6(9)4-3-5(7)8/h3-4H,2H2,1H3,(H,7,8)/b4-3+
InChIKey XLYMOEINVGRTEX-ONEGZZNKSA-N
Mol Weight 144.13 g/mol
Molecular Formula C6H8O4
Exact Mass 144.042259 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6PvOV4I3rsA
Name mono-Ethyl fumarate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 128422
CAS Registry Number 2459-05-4
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8O4
InChI InChI=1S/C6H8O4/c1-2-10-6(9)4-3-5(7)8/h3-4H,2H2,1H3,(H,7,8)/b4-3+
InChIKey XLYMOEINVGRTEX-ONEGZZNKSA-N
Observed nucleus 13C
Purity 95%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Fumaric acid monoethyl ester Monoethyl fumarate
Wiley ID SIAL_13CNMR_000797