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3,4-Bis(methylthio)-1,2-dioxo-cyclobut-3-ene
SpectraBase Compound ID JgUw5ns8D3P
InChI InChI=1S/C6H6O2S2/c1-9-5-3(7)4(8)6(5)10-2/h1-2H3
InChIKey VUQDDHLQBBTHIC-UHFFFAOYSA-N
Mol Weight 174.23 g/mol
Molecular Formula C6H6O2S2
Exact Mass 173.980922 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2V5f5mQhYZE
Name 3,4-Bis(methylthio)-1,2-dioxo-cyclobut-3-ene
CAS Registry Number 54131-97-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H6O2S2
InChI InChI=1S/C6H6O2S2/c1-9-5-3(7)4(8)6(5)10-2/h1-2H3
InChIKey VUQDDHLQBBTHIC-UHFFFAOYSA-N
Literature Reference G. Seitz, K. Mann, R. Schmiedel, Chem. Ber. 112, 990 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3NO2