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METHYL-(E,E)-5-THIENYL-N-PHENYL-3-OXO-1,4-PENTADIENE-1-AMINE-N-DITHIOCARBOXYLATE
SpectraBase Compound ID GGgLlWV492t
InChI InChI=1S/C17H15NOS3/c1-21-17(20)18(14-6-3-2-4-7-14)12-11-15(19)9-10-16-8-5-13-22-16/h2-13H,1H3/b10-9+,12-11+
InChIKey HVRMMEOJOKAAQE-HULFFUFUSA-N
Mol Weight 345.49 g/mol
Molecular Formula C17H15NOS3
Exact Mass 345.031578 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LCvl0UyUGiw
Name METHYL-(E,E)-5-THIENYL-N-PHENYL-3-OXO-1,4-PENTADIENE-1-AMINE-N-DITHIOCARBOXYLATE
Compound Number 4I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H15NOS3
InChI InChI=1S/C17H15NOS3/c1-21-17(20)18(14-6-3-2-4-7-14)12-11-15(19)9-10-16-8-5-13-22-16/h2-13H,1H3/b10-9+,12-11+
InChIKey HVRMMEOJOKAAQE-HULFFUFUSA-N
Literature Reference Author E.KLEINPETER,S.THOMAS,G.UHLIG,W.D.RUDORF
Literature Reference Citation MAGN.RES.CHEM.,31,714(1993)
Literature Reference DOI 10.1002/mrc.1260310805
Molecular Weight 345.492 g/mol
Solvent CDCl3:TMS
Source File Reference UWRK1201