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4,4'-(ALPHA'',OMEGA''-DIAMINOGLUTAROYL)-BIS-(9-THIOACRIDANONE)
SpectraBase Compound ID DxXICEEaT1Q
InChI InChI=1S/C31H24N4O2S2/c36-26(32-24-14-5-10-20-28(24)34-22-12-3-1-8-18(22)30(20)38)16-7-17-27(37)33-25-15-6-11-21-29(25)35-23-13-4-2-9-19(23)31(21)39/h1-6,8-15H,7,16-17H2,(H,32,36)(H,33,37)(H,34,38)(H,35,39)
InChIKey SZLPULHALROGCR-UHFFFAOYSA-N
Mol Weight 548.68 g/mol
Molecular Formula C31H24N4O2S2
Exact Mass 548.134068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5r5xYHam2y
Name 4,4'-(ALPHA'',OMEGA''-DIAMINOGLUTAROYL)-BIS-(9-THIOACRIDANONE)
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H24N4O2S2
InChI InChI=1S/C31H24N4O2S2/c36-26(32-24-14-5-10-20-28(24)34-22-12-3-1-8-18(22)30(20)38)16-7-17-27(37)33-25-15-6-11-21-29(25)35-23-13-4-2-9-19(23)31(21)39/h1-6,8-15H,7,16-17H2,(H,32,36)(H,33,37)(H,34,38)(H,35,39)
InChIKey SZLPULHALROGCR-UHFFFAOYSA-N
Literature Reference Author R.VIDAL,J.P.GALY,E.J.VINCENT,A.M.GALY,J.BARBE
Literature Reference Citation HETEROCYCLES,24,1419(1986)
Literature Reference DOI 10.3987/R-1986-05-1419
Molecular Weight 548.677 g/mol
Solvent CF3COOD
Source File Reference UWED8454