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4-Ethyl-3-oxobis[1,2]dithiolo[3,4-b:4',3'-e][1,4]thiazine-5-(N-ethoxycarbonyl)imine
SpectraBase Compound ID Gq8Kmytkr5h
InChI InChI=1S/C11H10N2O3S5/c1-3-13-5-7(12-11(15)16-4-2)18-20-9(5)17-10-6(13)8(14)19-21-10/h3-4H2,1-2H3/b12-7-
InChIKey JVKOGCBJLUDNBR-GHXNOFRVSA-N
Mol Weight 378.5 g/mol
Molecular Formula C11H10N2O3S5
Exact Mass 377.929498 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 31gHTBGCfQx
Name 4-ETHYL-3-OXO-BIS-[1,2]-DITHIOLO-[3,4-B:4',3'-E]-[1,4]-THIAZINE-5-(N-ETHOXYCARBONYL)-IMINE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H10N2O3S5
InChI InChI=1S/C11H10N2O3S5/c1-3-13-5-7(12-11(15)16-4-2)18-20-9(5)17-10-6(13)8(14)19-21-10/h3-4H2,1-2H3/b12-7-
InChIKey JVKOGCBJLUDNBR-GHXNOFRVSA-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 378.512 g/mol
Solvent CDCl3
Source File Reference UWVN24091