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(5Z)-4-(benzyl)-3-(methylthio)-5-(nitrosomethylene)dithiole
SpectraBase Compound ID 2MsadIXw9Oi
InChI InChI=1S/C12H11NOS3/c1-15-12-10(11(8-13-14)16-17-12)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3/b11-8-
InChIKey FHMXSTZOUVZCQE-FLIBITNWSA-N
Mol Weight 281.41 g/mol
Molecular Formula C12H11NOS3
Exact Mass 281.000277 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CiXhYpjSDZ
Name (5Z)-4-(benzyl)-3-(methylthio)-5-(nitrosomethylene)dithiole
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11NOS3
InChI InChI=1S/C12H11NOS3/c1-15-12-10(11(8-13-14)16-17-12)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3/b11-8-
InChIKey FHMXSTZOUVZCQE-FLIBITNWSA-N
Literature Reference Author M.CHOLLET-KRUGLER,E.FINNER,M.O.CHRISTEN,J.L.BURGOT
Literature Reference Citation J.HETCYCL.CHEM.,40,155(2003)
Literature Reference DOI 10.1002/jhet.5570400121
Molecular Weight 281.405 g/mol
Solvent CDCl3
Source File Reference UWMS22356