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Malonic acid diethyl ester

View entire compound with spectra: 43 NMR, 18 FTIR, 1 Raman, 25 MS (GC), and 2 Near IR

Malonic acid diethyl ester
SpectraBase Compound ID 36RvTSC8wwK
InChI InChI=1S/C7H12O4/c1-3-10-6(8)5-7(9)11-4-2/h3-5H2,1-2H3
InChIKey IYXGSMUGOJNHAZ-UHFFFAOYSA-N
Mol Weight 160.17 g/mol
Molecular Formula C7H12O4
Exact Mass 160.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DA6hp9mCdI1
Name Malonic acid, diethyl ester
CAS Registry Number 105-53-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H12O4
InChI InChI=1S/C7H12O4/c1-3-10-6(8)5-7(9)11-4-2/h3-5H2,1-2H3
InChIKey IYXGSMUGOJNHAZ-UHFFFAOYSA-N
Instrument Name Varian HA-100
Literature Reference G.A. Olah, P.W. Westerman, J. Org. Chem. 38, 1986 (1973).
NMR Standard CS2
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Neat liquid