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(2S,3S)-N-Acetoacetyl-isoleucine methyl ester
SpectraBase Compound ID BXiWYimfWK1
InChI InChI=1S/C11H19NO4/c1-5-7(2)10(11(15)16-4)12-9(14)6-8(3)13/h7,10H,5-6H2,1-4H3,(H,12,14)
InChIKey BLZZGLZKKHHTKI-UHFFFAOYSA-N
Mol Weight 229.28 g/mol
Molecular Formula C11H19NO4
Exact Mass 229.131408 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1mSMnULlLsg
Name (2S,3S)-N-Acetoacetyl-isoleucine methyl ester
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C11H19NO4
InChI InChI=1S/C11H19NO4/c1-5-7(2)10(11(15)16-4)12-9(14)6-8(3)13/h7,10H,5-6H2,1-4H3,(H,12,14)
InChIKey BLZZGLZKKHHTKI-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference S.V. Ley, S.C. Smith, P.R. Woodward, Tetrahedron 48, 1145 (1992).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3