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3-PHENYL-5-DI-(ETHOXYCARBONYL)-METHYL-1,2,3,4-THIATRIAZOLE
SpectraBase Compound ID G0BNqEHxK8Q
InChI InChI=1S/C14H16N3O4S/c1-3-20-13(18)11(14(19)21-4-2)12-15-17(16-22-12)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3/q+1
InChIKey XTPTWHRABPFJEE-UHFFFAOYSA-N
Mol Weight 322.36 g/mol
Molecular Formula C14H16N3O4S
Exact Mass 322.086152 g/mol
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6(0.1-0.5M)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent SOLID_STATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6(0.1-0.5M)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent SOLID-STATE
  • 3-PHENYL-1,2,3,4-THIATRIAZOLIUM-5-DI-(ETHOXYCARBONYL)-METHYLIDE
  • 3-PHENYL-1-THIA-2,3,4-TRIAZOL-3-IUM-5-YL-METHANIDE-DERIVATIVE
Title Journal or Book Year
Mesoionic compounds — structure and NMR parameters Chemistry of Heterocyclic Compounds 1995
Structural studies on mesoionic 1,2,3,4-thiatriazolo-5-aminides and 1,2,3,4-thiatriazolo-5-methylides by nitrogen and carbon NMR Magnetic Resonance in Chemistry 1993

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