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4-ACETYL-2-ACETYLAMINO-5-ISOPROPENYL-4,5-DIHYDRO-1,3,4-THIADIAZOLE
SpectraBase Compound ID 79OevXTJI9r
InChI InChI=1S/C9H13N3O2S/c1-5(2)8-12(7(4)14)11-9(15-8)10-6(3)13/h8H,1H2,2-4H3,(H,10,11,13)
InChIKey KQSCVMHAWSURFX-UHFFFAOYSA-N
Mol Weight 227.28 g/mol
Molecular Formula C9H13N3O2S
Exact Mass 227.072848 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AaUhLKcog42
Name 4-ACETYL-2-ACETYLAMINO-5-ISOPROPENYL-4,5-DIHYDRO-1,3,4-THIADIAZOLE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13N3O2S
InChI InChI=1S/C9H13N3O2S/c1-5(2)8-12(7(4)14)11-9(15-8)10-6(3)13/h8H,1H2,2-4H3,(H,10,11,13)
InChIKey KQSCVMHAWSURFX-UHFFFAOYSA-N
Literature Reference Author S.ANDREAE,E.SCHMITZ,H.SEEBOTH
Literature Reference Citation J.PRAKT.CHEM.,328,205(1986)
Literature Reference DOI 10.1002/prac.19863280209
Molecular Weight 227.281 g/mol
Solvent DMSO-D6
Source File Reference UWED10227