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2-Amino-3-methyl-4-nitro-butanoic acid, methyl ester
SpectraBase Compound ID LeiAx1i1ecH
InChI InChI=1S/C6H12N2O4/c1-4(3-8(10)11)5(7)6(9)12-2/h4-5H,3,7H2,1-2H3
InChIKey LWUVFCVFRNOXHD-UHFFFAOYSA-N
Mol Weight 176.17 g/mol
Molecular Formula C6H12N2O4
Exact Mass 176.079707 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9TvbA9qFX29
Name 2-Amino-3-methyl-4-nitro-butanoic acid, methyl ester
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H12N2O4
InChI InChI=1S/C6H12N2O4/c1-4(3-8(10)11)5(7)6(9)12-2/h4-5H,3,7H2,1-2H3
InChIKey LWUVFCVFRNOXHD-UHFFFAOYSA-N
Literature Reference U. Schoellkopf, W. Kuehnle, E. Egert, Angew. Chem. 99, 480 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3