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4-methyl-5-(trifluoromethyl)-2H-1,2,4-triazole-3-thione

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4-methyl-5-(trifluoromethyl)-2H-1,2,4-triazole-3-thione
SpectraBase Compound ID 4Qeayz9PBK6
InChI InChI=1S/C4H4F3N3S/c1-10-2(4(5,6)7)8-9-3(10)11/h1H3,(H,9,11)
InChIKey HUZASKHMPBJXJP-UHFFFAOYSA-N
Mol Weight 183.15 g/mol
Molecular Formula C4H4F3N3S
Exact Mass 183.007803 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3xivDb9bkcD
Name 4-methyl-5-(trifluoromethyl)-2H-1,2,4-triazole-3-thione
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H4F3N3S
InChI InChI=1S/C4H4F3N3S/c1-10-2(4(5,6)7)8-9-3(10)11/h1H3,(H,9,11)
InChIKey HUZASKHMPBJXJP-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 183.151 g/mol
Source File Reference MHKO13212