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3-PHENYL-5-(METHYLCARBONYL-ETHYLCARBOYNLMETHYL)-1,2,3,4-THIATRIAZOLE

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3-PHENYL-5-(METHYLCARBONYL-ETHYLCARBOYNLMETHYL)-1,2,3,4-THIATRIAZOLE
SpectraBase Compound ID GRognD3vup7
InChI InChI=1S/C13H14N3O4S/c1-3-20-13(18)10(12(17)19-2)11-14-16(15-21-11)9-7-5-4-6-8-9/h4-8,10H,3H2,1-2H3/q+1
InChIKey ZPJOVRDJIUGLTE-UHFFFAOYSA-N
Mol Weight 308.33 g/mol
Molecular Formula C13H14N3O4S
Exact Mass 308.070502 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GipmZww5JoK
Name 3-PHENYL-5-(METHYLCARBONYL-ETHYLCARBOYNLMETHYL)-1,2,3,4-THIATRIAZOLE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14N3O4S
InChI InChI=1S/C13H14N3O4S/c1-3-20-13(18)10(12(17)19-2)11-14-16(15-21-11)9-7-5-4-6-8-9/h4-8,10H,3H2,1-2H3/q+1
InChIKey ZPJOVRDJIUGLTE-UHFFFAOYSA-N
Literature Reference Author L.STEFANIAK,J.JAZWINSKI
Literature Reference Citation CHEM.HET.COMP.,31,1027(1995)
Literature Reference DOI 10.1007/bf01165049
Molecular Weight 308.332 g/mol
Solvent CDCl3
Source File Reference UWMZ14924