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N-(2,4,6-Trinitro-phenyl)-A-alanine methyl ester

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N-(2,4,6-Trinitro-phenyl)-A-alanine methyl ester
SpectraBase Compound ID K4yljCh2iub
InChI InChI=1S/C10H10N4O8/c1-5(10(15)22-2)11-9-7(13(18)19)3-6(12(16)17)4-8(9)14(20)21/h3-5,11H,1-2H3
InChIKey KMULYQAVFKXQFI-UHFFFAOYSA-N
Mol Weight 314.21 g/mol
Molecular Formula C10H10N4O8
Exact Mass 314.049863 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B4osN1UqA6u
Name N-(2,4,6-Trinitro-phenyl)-A-alanine methyl ester
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C10H10N4O8
InChI InChI=1S/C10H10N4O8/c1-5(10(15)22-2)11-9-7(13(18)19)3-6(12(16)17)4-8(9)14(20)21/h3-5,11H,1-2H3
InChIKey KMULYQAVFKXQFI-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference V. Machacek, M.M. Hassanien, V. Sterba, J. Chem. Soc. Perkin II 867 (1987).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6