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2-([Ethoxy][diethoxycarbonyl]-methylamino)-4-nit ro-benzoic acid, ethyl ester
SpectraBase Compound ID EdNRp68FPvP
InChI InChI=1S/C18H24N2O9/c1-5-26-15(21)13-10-9-12(20(24)25)11-14(13)19-18(29-8-4,16(22)27-6-2)17(23)28-7-3/h9-11,19H,5-8H2,1-4H3
InChIKey XTDLYKLBSKXNPH-UHFFFAOYSA-N
Mol Weight 412.4 g/mol
Molecular Formula C18H24N2O9
Exact Mass 412.14818 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 26zSgvDuami
Name 2-([Ethoxy][diethoxycarbonyl]-methylamino)-4-nit ro-benzoic acid, ethyl ester
CAS Registry Number 87840-67-3
Comments reassigned
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Formula C18H24N2O9
InChI InChI=1S/C18H24N2O9/c1-5-26-15(21)13-10-9-12(20(24)25)11-14(13)19-18(29-8-4,16(22)27-6-2)17(23)28-7-3/h9-11,19H,5-8H2,1-4H3
InChIKey XTDLYKLBSKXNPH-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference S. Wnuk, E. Wyrzykiewicz, E. Kaczmarek, Magn. Res. Chem. 28, 271 (1990).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3