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1-(5-AMINO-3-DIMETHYAMINO-1H-1,2,4-TRIAZOL-1-YL)-5-PHENYLAMINO-4-METHYL-4,5-DIHYDRO-1,3,4-THIADIAZOLE
SpectraBase Compound ID 9kHf4u1DLcs
InChI InChI=1S/C13H16N8S/c1-19(2)11-16-10(14)21(17-11)13-18-20(3)12(22-13)15-9-7-5-4-6-8-9/h4-8H,1-3H3,(H2,14,16,17)/b15-12+
InChIKey IVLDBSDZFLOXRW-NTCAYCPXSA-N
Mol Weight 316.39 g/mol
Molecular Formula C13H16N8S
Exact Mass 316.121864 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jsx2SsMMZuV
Name 1-(5-AMINO-3-DIMETHYAMINO-1H-1,2,4-TRIAZOL-1-YL)-5-PHENYLAMINO-4-METHYL-4,5-DIHYDRO-1,3,4-THIADIAZOLE
CAS Registry Number 153935-84-3
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16N8S
InChI InChI=1S/C13H16N8S/c1-19(2)11-16-10(14)21(17-11)13-18-20(3)12(22-13)15-9-7-5-4-6-8-9/h4-8H,1-3H3,(H2,14,16,17)/b15-12+
InChIKey IVLDBSDZFLOXRW-NTCAYCPXSA-N
Literature Reference Author J.REITER,J.BARKOCZY
Literature Reference Citation J.HETCYCL.CHEM.,30,333(1993)
Literature Reference DOI 10.1002/jhet.5570300207
Molecular Weight 316.384 g/mol
Solvent DMSO-D6
Source File Reference UWPB254