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5-amino-N-[(4-dimethylaminobenzylidene)amino]-N-methyl-3-(methylthio)-1,2,4-triazole-1-carbothioamide
SpectraBase Compound ID DxElszcb2Bp
InChI InChI=1S/C14H19N7S2/c1-19(2)11-7-5-10(6-8-11)9-16-20(3)14(22)21-12(15)17-13(18-21)23-4/h5-9H,1-4H3,(H2,15,17,18)/b16-9+
InChIKey HLOVFWBWVWNZHU-CXUHLZMHSA-N
Mol Weight 349.48 g/mol
Molecular Formula C14H19N7S2
Exact Mass 349.114336 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DPkvJVx2brN
Name 5-amino-N-[(4-dimethylaminobenzylidene)amino]-N-methyl-3-(methylthio)-1,2,4-triazole-1-carbothioamide
Compound Number 19/20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H19N7S2
InChI InChI=1S/C14H19N7S2/c1-19(2)11-7-5-10(6-8-11)9-16-20(3)14(22)21-12(15)17-13(18-21)23-4/h5-9H,1-4H3,(H2,15,17,18)/b16-9+
InChIKey HLOVFWBWVWNZHU-CXUHLZMHSA-N
Literature Reference Author J.BARKOCZY,J.REITER
Literature Reference Citation J.HETCYCL.CHEM.,30,1009(1993)
Literature Reference DOI 10.1002/jhet.5570300429
Molecular Weight 349.472 g/mol
Solvent CDCl3
Source File Reference UWGE822