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2-[2-3,5-DI-[2-(1,3-DIOXO-2,3-DIHYDRO-1H-2-ISOINDOLYL)-ACETYL]-PHENYL-2-OXOETHYL]-1,3-ISOINDOLINEDIONE
SpectraBase Compound ID BBJ66vPffTK
InChI InChI=1S/C36H21N3O9/c40-28(16-37-31(43)22-7-1-2-8-23(22)32(37)44)19-13-20(29(41)17-38-33(45)24-9-3-4-10-25(24)34(38)46)15-21(14-19)30(42)18-39-35(47)26-11-5-6-12-27(26)36(39)48/h1-15H,16-18H2
InChIKey PDOLBUAJNVFXHU-UHFFFAOYSA-N
Mol Weight 639.6 g/mol
Molecular Formula C36H21N3O9
Exact Mass 639.127779 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I6Cv9RcvtoQ
Name 2-[2-3,5-DI-[2-(1,3-DIOXO-2,3-DIHYDRO-1H-2-ISOINDOLYL)-ACETYL]-PHENYL-2-OXOETHYL]-1,3-ISOINDOLINEDIONE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H21N3O9
InChI InChI=1S/C36H21N3O9/c40-28(16-37-31(43)22-7-1-2-8-23(22)32(37)44)19-13-20(29(41)17-38-33(45)24-9-3-4-10-25(24)34(38)46)15-21(14-19)30(42)18-39-35(47)26-11-5-6-12-27(26)36(39)48/h1-15H,16-18H2
InChIKey PDOLBUAJNVFXHU-UHFFFAOYSA-N
Literature Reference Author S.M.AL-MOUSAWI,M.A.EL-APASERY,M.H.ELNAGDI
Literature Reference Citation MOLECULES,15,58(2010)
Literature Reference DOI 10.3390/molecules15010058
Molecular Weight 639.577 g/mol
Sample ID 69113
Solvent DMSO-D6