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2-[2-(3,4-DIMETHOXYPHENYL)-3-METHYL-4-OXOAZETIDIN-3-YL]-4-NITROISOINDOLE-1,3-DIONE
SpectraBase Compound ID Itcjah2yqj1
InChI InChI=1S/C20H17N3O7/c1-20(16(21-19(20)26)10-7-8-13(29-2)14(9-10)30-3)22-17(24)11-5-4-6-12(23(27)28)15(11)18(22)25/h4-9,16H,1-3H3,(H,21,26)/t16-,20+/m0/s1
InChIKey XBZRQMOUDMEVHJ-OXJNMPFZSA-N
Mol Weight 411.37 g/mol
Molecular Formula C20H17N3O7
Exact Mass 411.10665 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K4dsSM8xfAA
Name 2-[2-(3,4-DIMETHOXYPHENYL)-3-METHYL-4-OXOAZETIDIN-3-YL]-4-NITROISOINDOLE-1,3-DIONE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H17N3O7
InChI InChI=1S/C20H17N3O7/c1-20(16(21-19(20)26)10-7-8-13(29-2)14(9-10)30-3)22-17(24)11-5-4-6-12(23(27)28)15(11)18(22)25/h4-9,16H,1-3H3,(H,21,26)/t16-,20+/m0/s1
InChIKey XBZRQMOUDMEVHJ-OXJNMPFZSA-N
Literature Reference Author A.JARRAHPOUR,M.ZAREI
Literature Reference Citation MOLECULES,11,49(2006)
Literature Reference DOI 10.3390/11010049
Molecular Weight 411.371 g/mol
Sample ID 46184
Solvent CDCl3