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5-amino-N-[(4-fluorobenzylidene)amino]-N-methyl-3-(methylthio)-1,2,4-triazole-1-carbothioamide

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5-amino-N-[(4-fluorobenzylidene)amino]-N-methyl-3-(methylthio)-1,2,4-triazole-1-carbothioamide
SpectraBase Compound ID AtUPmLeF8TL
InChI InChI=1S/C12H13FN6S2/c1-18(15-7-8-3-5-9(13)6-4-8)12(20)19-10(14)16-11(17-19)21-2/h3-7H,1-2H3,(H2,14,16,17)/b15-7+
InChIKey UBNAABSBOPFHHD-VIZOYTHASA-N
Mol Weight 324.4 g/mol
Molecular Formula C12H13FN6S2
Exact Mass 324.062715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7LkBI3yE0Wa
Name 5-amino-N-[(4-fluorobenzylidene)amino]-N-methyl-3-(methylthio)-1,2,4-triazole-1-carbothioamide
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13FN6S2
InChI InChI=1S/C12H13FN6S2/c1-18(15-7-8-3-5-9(13)6-4-8)12(20)19-10(14)16-11(17-19)21-2/h3-7H,1-2H3,(H2,14,16,17)/b15-7+
InChIKey UBNAABSBOPFHHD-VIZOYTHASA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 324.394 g/mol
Source File Reference MHKO15082