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2-[4-[(E)-[[5-amino-3-(methylthio)1,2,4-triazole-1-carbothioyl]-methyl-hydrazono]methyl]phenoxy]acetamide

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2-[4-[(E)-[[5-amino-3-(methylthio)1,2,4-triazole-1-carbothioyl]-methyl-hydrazono]methyl]phenoxy]acetamide
SpectraBase Compound ID 6UncbkzGm3Y
InChI InChI=1S/C14H17N7O2S2/c1-20(14(24)21-12(16)18-13(19-21)25-2)17-7-9-3-5-10(6-4-9)23-8-11(15)22/h3-7H,8H2,1-2H3,(H2,15,22)(H2,16,18,19)/b17-7+
InChIKey QEOWATRQXVYTBA-REZTVBANSA-N
Mol Weight 379.46 g/mol
Molecular Formula C14H17N7O2S2
Exact Mass 379.088515 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7DlBokjAK3A
Name 2-[4-[(E)-[[5-amino-3-(methylthio)1,2,4-triazole-1-carbothioyl]-methyl-hydrazono]methyl]phenoxy]acetamide
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H17N7O2S2
InChI InChI=1S/C14H17N7O2S2/c1-20(14(24)21-12(16)18-13(19-21)25-2)17-7-9-3-5-10(6-4-9)23-8-11(15)22/h3-7H,8H2,1-2H3,(H2,15,22)(H2,16,18,19)/b17-7+
InChIKey QEOWATRQXVYTBA-REZTVBANSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 379.455 g/mol
Source File Reference MHKO15081