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METHYL-(6R*,1'R*)-5-ETHYLOXYCARBONYL-6-[1'-(1''H-IMIDAZOL-4''-YL)-2'-NITRO-ETHYL]-4,5,6,7-TETRAHYDRO-3H-IMIDAZO-[4,5-C]-PYRIDIN-6-CARBOXYLATE

View entire compound with spectra: 1 NMR

METHYL-(6R*,1'R*)-5-ETHYLOXYCARBONYL-6-[1'-(1''H-IMIDAZOL-4''-YL)-2'-NITRO-ETHYL]-4,5,6,7-TETRAHYDRO-3H-IMIDAZO-[4,5-C]-PYRIDIN-6-CARBOXYLATE
SpectraBase Compound ID E5zDAOkJye0
InChI InChI=1S/C16H20N6O6/c1-3-28-15(24)21-7-13-11(19-9-20-13)4-16(21,14(23)27-2)10(6-22(25)26)12-5-17-8-18-12/h5,8-10H,3-4,6-7H2,1-2H3,(H,17,18)(H,19,20)/t10-,16-/m1/s1
InChIKey RVJBRFNMXPKXFI-QLJPJBMISA-N
Mol Weight 392.37 g/mol
Molecular Formula C16H20N6O6
Exact Mass 392.144432 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7BcO0E8emXF
Name METHYL-(6R*,1'R*)-5-ETHYLOXYCARBONYL-6-[1'-(1''H-IMIDAZOL-4''-YL)-2'-NITRO-ETHYL]-4,5,6,7-TETRAHYDRO-3H-IMIDAZO-[4,5-C]-PYRIDIN-6-CARBOXYLATE
Compound Number 7B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20N6O6
InChI InChI=1S/C16H20N6O6/c1-3-28-15(24)21-7-13-11(19-9-20-13)4-16(21,14(23)27-2)10(6-22(25)26)12-5-17-8-18-12/h5,8-10H,3-4,6-7H2,1-2H3,(H,17,18)(H,19,20)/t10-,16-/m1/s1
InChIKey RVJBRFNMXPKXFI-QLJPJBMISA-N
Literature Reference Author M.F.BRANA,C.GUISADO,F.SANZ
Literature Reference Citation J.HETCYCL.CHEM.,40,917(2003)
Literature Reference DOI 10.1002/jhet.5570400528
Molecular Weight 392.371 g/mol
Solvent DMSO-D6
Source File Reference UWMS22867