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

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N-(2,4,6-Trinitro-phenyl)-A-alanine ethyl ester
SpectraBase Compound ID E2X9QhxoFgS
InChI InChI=1S/C11H12N4O8/c1-3-23-11(16)6(2)12-10-8(14(19)20)4-7(13(17)18)5-9(10)15(21)22/h4-6,12H,3H2,1-2H3
InChIKey PRJFWGUFNOSAAX-UHFFFAOYSA-N
Mol Weight 328.24 g/mol
Molecular Formula C11H12N4O8
Exact Mass 328.065513 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Zv5JiccpYt
Name N-(2,4,6-Trinitro-phenyl)-A-alanine ethyl ester
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H12N4O8
InChI InChI=1S/C11H12N4O8/c1-3-23-11(16)6(2)12-10-8(14(19)20)4-7(13(17)18)5-9(10)15(21)22/h4-6,12H,3H2,1-2H3
InChIKey PRJFWGUFNOSAAX-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