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4-Ethyl-3-oxobis[1,2]dithiolo[4,3-b:3',4'-d]pyrrole-5-(N-ethoxycarbonyl)imine
SpectraBase Compound ID HVPLDFoJsRN
InChI InChI=1S/C11H10N2O3S4/c1-3-13-5-7(8-6(13)10(14)20-18-8)17-19-9(5)12-11(15)16-4-2/h3-4H2,1-2H3/b12-9-
InChIKey ARQDDBDSOMKGNQ-XFXZXTDPSA-N
Mol Weight 346.5 g/mol
Molecular Formula C11H10N2O3S4
Exact Mass 345.957427 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KTUkBMalKv1
Name 4-ETHYL-3-OXO-BIS-[1,2]-DITHIOLO-[4,3-B:3',4'-D]-PYRROLE-5-(N-ETHOXYCARBONYL)-IMINE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H10N2O3S4
InChI InChI=1S/C11H10N2O3S4/c1-3-13-5-7(8-6(13)10(14)20-18-8)17-19-9(5)12-11(15)16-4-2/h3-4H2,1-2H3/b12-9-
InChIKey ARQDDBDSOMKGNQ-XFXZXTDPSA-N
Literature Reference Author S.BARRIGA,P.FUERTES,C.F.MARCOS,D.MIGUEL,O.A.RAKITIN,C.W.REES ,T.TORROBA
Literature Reference Citation J.ORG.CHEM.,66,5766(2001)
Literature Reference DOI 10.1021/jo010368u
Molecular Weight 346.452 g/mol
Solvent CDCl3
Source File Reference UWVN24092