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2-[2-(3,4-DIMETHOXYPHENYL)-4-OXO-1-(TOLUENE-4-SULFONYL)-AZETIDIN-3-YL]-4-NITROISOINDOLE-1,3-DIONE

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2-[2-(3,4-DIMETHOXYPHENYL)-4-OXO-1-(TOLUENE-4-SULFONYL)-AZETIDIN-3-YL]-4-NITROISOINDOLE-1,3-DIONE
SpectraBase Compound ID EiO8Te5n3NL
InChI InChI=1S/C26H21N3O9S/c1-14-7-10-16(11-8-14)39(35,36)28-22(15-9-12-19(37-2)20(13-15)38-3)23(26(28)32)27-24(30)17-5-4-6-18(29(33)34)21(17)25(27)31/h4-13,22-23H,1-3H3/t22-,23+/m0/s1
InChIKey GUZSGCGQMWOCSM-XZOQPEGZSA-N
Mol Weight 551.53 g/mol
Molecular Formula C26H21N3O9S
Exact Mass 551.09985 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cz51EHFdZSc
Name 2-[2-(3,4-DIMETHOXYPHENYL)-4-OXO-1-(TOLUENE-4-SULFONYL)-AZETIDIN-3-YL]-4-NITROISOINDOLE-1,3-DIONE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H21N3O9S
InChI InChI=1S/C26H21N3O9S/c1-14-7-10-16(11-8-14)39(35,36)28-22(15-9-12-19(37-2)20(13-15)38-3)23(26(28)32)27-24(30)17-5-4-6-18(29(33)34)21(17)25(27)31/h4-13,22-23H,1-3H3/t22-,23+/m0/s1
InChIKey GUZSGCGQMWOCSM-XZOQPEGZSA-N
Literature Reference Author A.JARRAHPOUR,M.ZAREI
Literature Reference Citation MOLECULES,11,49(2006)
Literature Reference DOI 10.3390/11010049
Molecular Weight 551.527 g/mol
Sample ID 46188
Solvent DMSO-D6