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2-imidazolidin-2-ylidene-3-phenyl-3-thioxo-propionitrile
SpectraBase Compound ID Bi4MwXPNp92
InChI InChI=1S/C12H11N3S/c13-8-10(12-14-6-7-15-12)11(16)9-4-2-1-3-5-9/h1-5,14-15H,6-7H2
InChIKey ZPVIBBJKGRHZHO-UHFFFAOYSA-N
Mol Weight 229.3 g/mol
Molecular Formula C12H11N3S
Exact Mass 229.067369 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 14JgWZjxG6o
Name 2-imidazolidin-2-ylidene-3-phenyl-3-thioxo-propionitrile
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11N3S
InChI InChI=1S/C12H11N3S/c13-8-10(12-14-6-7-15-12)11(16)9-4-2-1-3-5-9/h1-5,14-15H,6-7H2
InChIKey ZPVIBBJKGRHZHO-UHFFFAOYSA-N
Literature Reference Author E.KLEINPETER,S.KLOD,W.D.RUDORF
Literature Reference Citation J.ORG.CHEM.,69,4317(2004)
Literature Reference DOI 10.1021/jo0496345
Molecular Weight 229.299 g/mol
Solvent CDCl3
Source File Reference UWVN21720