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Cyano-malonic acid, dimethyl ester anion
SpectraBase Compound ID Fz9yKKSXqXL
InChI InChI=1S/C6H6NO4/c1-10-5(8)4(3-7)6(9)11-2/h1-2H3/q-1
InChIKey NWLUUOFCDMRLJI-UHFFFAOYSA-N
Mol Weight 156.12 g/mol
Molecular Formula C6H6NO4
Exact Mass 156.029683 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Iu9SDGig4ET
Name Cyano-malonic acid, dimethyl ester anion
Comments SOLVENT: CD3OD + D2O, POTASSIUM SALT
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Formula C6H6NO4
InChI InChI=1S/C6H6NO4/c1-10-5(8)4(3-7)6(9)11-2/h1-2H3/q-1
InChIKey NWLUUOFCDMRLJI-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference R. Neidlein, S. Throm, Arch. Pharm. 313, 891 (1980).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3OD