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2-(6-Methyl-2-nitro-benzyl)-nicotinic acid, ethyl ester

View entire compound with spectra: 1 NMR

2-(6-Methyl-2-nitro-benzyl)-nicotinic acid, ethyl ester
SpectraBase Compound ID QkMZnkuskA
InChI InChI=1S/C16H16N2O4/c1-3-22-16(19)12-7-5-9-17-14(12)10-13-11(2)6-4-8-15(13)18(20)21/h4-9H,3,10H2,1-2H3
InChIKey JTYVMDYNGODYPA-UHFFFAOYSA-N
Mol Weight 300.31 g/mol
Molecular Formula C16H16N2O4
Exact Mass 300.111007 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BAbcTKsKSC4
Name 2-(6-Methyl-2-nitro-benzyl)-nicotinic acid, ethyl ester
CAS Registry Number 119209-38-0
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C16H16N2O4
InChI InChI=1S/C16H16N2O4/c1-3-22-16(19)12-7-5-9-17-14(12)10-13-11(2)6-4-8-15(13)18(20)21/h4-9H,3,10H2,1-2H3
InChIKey JTYVMDYNGODYPA-UHFFFAOYSA-N
Instrument Name Jeol GX-400
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