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N-Butyl-malonic-acid, mono-methylester
SpectraBase Compound ID 8JJ851CTiuN
InChI InChI=1S/C8H14O4/c1-3-4-5-6(7(9)10)8(11)12-2/h6H,3-5H2,1-2H3,(H,9,10)
InChIKey GIQUGXMHRJYRKI-UHFFFAOYSA-N
Mol Weight 174.2 g/mol
Molecular Formula C8H14O4
Exact Mass 174.089209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1qqzhul0MmM
Name N-Butyl-malonic-acid, mono-methylester
CAS Registry Number 73891-59-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H14O4
InChI InChI=1S/C8H14O4/c1-3-4-5-6(7(9)10)8(11)12-2/h6H,3-5H2,1-2H3,(H,9,10)
InChIKey GIQUGXMHRJYRKI-UHFFFAOYSA-N
Instrument Name SF = 100 MHz
Literature Reference J. Org. Chem. 45, 3268 (1980).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3