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4-(2-Chloro-6-nitro-phenyl)-acetoacetic acid, ethyl ester

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4-(2-Chloro-6-nitro-phenyl)-acetoacetic acid, ethyl ester
SpectraBase Compound ID Ejp61inedIq
InChI InChI=1S/C12H12ClNO5/c1-2-19-12(16)7-8(15)6-9-10(13)4-3-5-11(9)14(17)18/h3-5H,2,6-7H2,1H3
InChIKey GLXCXMHVCRMGBI-UHFFFAOYSA-N
Mol Weight 285.68 g/mol
Molecular Formula C12H12ClNO5
Exact Mass 285.0404 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lvhmhh53ti
Name 4-(2-Chloro-6-nitro-phenyl)-acetoacetic acid, ethyl ester
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H12ClNO5
InChI InChI=1S/C12H12ClNO5/c1-2-19-12(16)7-8(15)6-9-10(13)4-3-5-11(9)14(17)18/h3-5H,2,6-7H2,1H3
InChIKey GLXCXMHVCRMGBI-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference W. Maier, Thesis (Ph.D.), Techn. Univ. of Munich, Germany (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3