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4,5-ETHYLENEDITHIO-4',5'-DICARBAMOYLTETRATHIAFULVALENE
SpectraBase Compound ID 3z0fhmBaSR8
InChI InChI=1S/C10H8N2O2S6/c11-5(13)3-4(6(12)14)18-9(17-3)10-19-7-8(20-10)16-2-1-15-7/h1-2H2,(H2,11,13)(H2,12,14)
InChIKey MLBVPUKNFZXZHF-UHFFFAOYSA-N
Mol Weight 380.5 g/mol
Molecular Formula C10H8N2O2S6
Exact Mass 379.891005 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GFkR3sv2jpY
Name 4,5-ETHYLENEDITHIO-4',5'-DICARBAMOYLTETRATHIAFULVALENE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H8N2O2S6
InChI InChI=1S/C10H8N2O2S6/c11-5(13)3-4(6(12)14)18-9(17-3)10-19-7-8(20-10)16-2-1-15-7/h1-2H2,(H2,11,13)(H2,12,14)
InChIKey MLBVPUKNFZXZHF-UHFFFAOYSA-N
Literature Reference Author S.A.BAUDRON,N.AVARVARI,P.BATAIL,C.COULON,R.CLERAC,E.CANADELL ,P.AUBAN-SENZIER
Literature Reference Citation J.AM.CHEM.SOC.,125,11583(2003)
Literature Reference DOI 10.1021/ja0356129
Molecular Weight 380.546 g/mol
Sample ID 35158
Solvent DMSO-D6