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2-Cyano-2-ethoxycarbonyl-dithioacetic acid, dianion

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2-Cyano-2-ethoxycarbonyl-dithioacetic acid, dianion
SpectraBase Compound ID C86tINzdr6B
InChI InChI=1S/C6H6NO2S2/c1-2-9-5(8)4(3-7)6(10)11/h2H2,1H3,(H,10,11)/q-1/p-1
InChIKey WBROKGZRBHSRQF-UHFFFAOYSA-M
Mol Weight 187.23 g/mol
Molecular Formula C6H5NO2S2
Exact Mass 186.976171 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2y4aTyHZuNJ
Name 2-Cyano-2-ethoxycarbonyl-dithioacetic acid, dianion
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H5NO2S2
InChI InChI=1S/C6H6NO2S2/c1-2-9-5(8)4(3-7)6(10)11/h2H2,1H3,(H,10,11)/q-1/p-1
InChIKey WBROKGZRBHSRQF-UHFFFAOYSA-M
Instrument Name Bruker WH-90
Literature Reference L. Henriksen, H. Eggert, Acta Chem. Scand. A32, 701 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6