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GKESNSNDOLYKQS-SRZZPIQSSA-N
SpectraBase Compound ID 50dDA3So75c
InChI InChI=1S/C20H19N3O6/c1-20(16-9-18-17(27-12-28-18)8-14(16)5-6-29-20)10-19(24)22-21-11-13-3-2-4-15(7-13)23(25)26/h2-4,7-9,11H,5-6,10,12H2,1H3,(H,22,24)/b21-11+
InChIKey GKESNSNDOLYKQS-SRZZPIQSSA-N
Mol Weight 397.39 g/mol
Molecular Formula C20H19N3O6
Exact Mass 397.127385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ewm8VnKIP8R
Name [1-(1-METHYL-6,7-METHYLENEDIOXY)-ISOCHROMANYL]-ACETYL-HYDRAZONO-3-NITROBENZYL;E-ISOMER
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H19N3O6
InChI InChI=1S/C20H19N3O6/c1-20(16-9-18-17(27-12-28-18)8-14(16)5-6-29-20)10-19(24)22-21-11-13-3-2-4-15(7-13)23(25)26/h2-4,7-9,11H,5-6,10,12H2,1H3,(H,22,24)/b21-11+
InChIKey GKESNSNDOLYKQS-SRZZPIQSSA-N
Literature Reference Author M.R.L.SANTOS,E.J.BARREIRO,R.BRAZ-FILHO,A.L.P.MIRANDA
Literature Reference Citation J.BRAZ.CHEM.SOC.,8,471(1997)
Literature Reference DOI 10.1590/s0103-50531997000500007
Molecular Weight 397.387 g/mol
Solvent CDCl3
Source File Reference UWPA1238