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2,3,7,8-Tetrachlorothianthrene-1,4,6,9-tetrone
SpectraBase Compound ID LQ49yW9pPKO
InChI InChI=1S/C12Cl4O4S2/c13-1-2(14)6(18)10-9(5(1)17)21-11-7(19)3(15)4(16)8(20)12(11)22-10
InChIKey SFVNDVOREWHBHU-UHFFFAOYSA-N
Mol Weight 414.1 g/mol
Molecular Formula C12Cl4O4S2
Exact Mass 411.799212 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BEIQz8Fmkaj
Name 2,3,7,8-TETRACHLOROTHIANTHRENE-1,4,6,9-TETRONE
Compound Number 13A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12Cl4O4S2
InChI InChI=1S/C12Cl4O4S2/c13-1-2(14)6(18)10-9(5(1)17)21-11-7(19)3(15)4(16)8(20)12(11)22-10
InChIKey SFVNDVOREWHBHU-UHFFFAOYSA-N
Literature Reference Author A.A.HASSAN,A.F.E.MOURAD,K.M.EL-SHAIEB,A.ABOU-ZIED
Literature Reference Citation J.HETCYCL.CHEM.,43,471(2006)
Literature Reference DOI 10.1002/jhet.5570430232
Molecular Weight 414.062 g/mol
Sample ID 41723
Solvent Unknown