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2-(6-Chloro-2-nitro-benzyl)-nicotinic acid, ethyl ester
SpectraBase Compound ID B4AxQWUomsc
InChI InChI=1S/C15H13ClN2O4/c1-2-22-15(19)10-5-4-8-17-13(10)9-11-12(16)6-3-7-14(11)18(20)21/h3-8H,2,9H2,1H3
InChIKey VNPUKNAKFHLBMK-UHFFFAOYSA-N
Mol Weight 320.73 g/mol
Molecular Formula C15H13ClN2O4
Exact Mass 320.056385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LL0oeTCutm9
Name 2-(6-Chloro-2-nitro-benzyl)-nicotinic acid, ethyl ester
CAS Registry Number 119209-37-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H13ClN2O4
InChI InChI=1S/C15H13ClN2O4/c1-2-22-15(19)10-5-4-8-17-13(10)9-11-12(16)6-3-7-14(11)18(20)21/h3-8H,2,9H2,1H3
InChIKey VNPUKNAKFHLBMK-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 DMSO