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3,5-BIS-[3-[BETA-(3-INDOLYL)-ACRYLOYLETHYLTHIOSEMICARBAZIDE]-PYRIDINE]-TOLUENE
SpectraBase Compound ID 6NxtwxxwCpR
InChI InChI=1S/C41H32N8O4/c1-27-20-32(46-40(50)52-48-36(30-8-6-18-42-23-30)16-14-28-25-44-38-12-4-2-10-34(28)38)22-33(21-27)47-41(51)53-49-37(31-9-7-19-43-24-31)17-15-29-26-45-39-13-5-3-11-35(29)39/h2-26,44-45H,1H3,(H,46,50)(H,47,51)/b16-14+,17-15+,48-36-,49-37+
InChIKey VSNKJSBRUNCZBJ-FEDHRVGJSA-N
Mol Weight 700.8 g/mol
Molecular Formula C41H32N8O4
Exact Mass 700.254652 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 598tE54jYJI
Name 3,5-BIS-[3-[BETA-(3-INDOLYL)-ACRYLOYLETHYLTHIOSEMICARBAZIDE]-PYRIDINE]-TOLUENE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H32N8O4
InChI InChI=1S/C41H32N8O4/c1-27-20-32(46-40(50)52-48-36(30-8-6-18-42-23-30)16-14-28-25-44-38-12-4-2-10-34(28)38)22-33(21-27)47-41(51)53-49-37(31-9-7-19-43-24-31)17-15-29-26-45-39-13-5-3-11-35(29)39/h2-26,44-45H,1H3,(H,46,50)(H,47,51)/b16-14+,17-15+,48-36-,49-37+
InChIKey VSNKJSBRUNCZBJ-FEDHRVGJSA-N
Literature Reference Author N.A.A.EL-LATIF,A.E.G.E.AMR,A.A.IBRAHIEM
Literature Reference Citation MH.CHEM.,138,559(2007)
Literature Reference DOI 10.1007/s00706-007-0628-z
Molecular Weight 700.756 g/mol
Sample ID 68472
Solvent DMSO-D6