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4-CYANO-2,5-DIMORPHOLINO-3-H-PYRROLE-3-THIONE
SpectraBase Compound ID IlwPmUFZwLm
InChI InChI=1S/C13H16N4O2S/c14-9-10-11(20)13(17-3-7-19-8-4-17)15-12(10)16-1-5-18-6-2-16/h1-8H2
InChIKey XZOURYINXUNZLD-UHFFFAOYSA-N
Mol Weight 292.36 g/mol
Molecular Formula C13H16N4O2S
Exact Mass 292.099397 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LnusRGPLsMc
Name 4-CYANO-2,5-DIMORPHOLINO-3-H-PYRROLE-3-THIONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16N4O2S
InChI InChI=1S/C13H16N4O2S/c14-9-10-11(20)13(17-3-7-19-8-4-17)15-12(10)16-1-5-18-6-2-16/h1-8H2
InChIKey XZOURYINXUNZLD-UHFFFAOYSA-N
Literature Reference Author P.A.KOUTENTIS,C.W.REES,A.J.P.WHITE,D.J.WILLIAMS
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2765(1998)
Literature Reference DOI 10.1039/a804815k
Molecular Weight 292.356 g/mol
Solvent CDCl3
Source File Reference UWMZ6251