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5-MERCAPTO-2,4-DIMETHYL-1,2,4-TRIAZOLINE-3-THIONE
SpectraBase Compound ID DxRyerlgBb0
InChI InChI=1S/C4H7N3S2/c1-6-3(8)5-7(2)4(6)9/h1-2H3,(H,5,8)
InChIKey UPFWWNKDKAPMSV-UHFFFAOYSA-N
Mol Weight 161.24 g/mol
Molecular Formula C4H7N3S2
Exact Mass 161.00814 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1JNZ6Byg5Kl
Name 5-MERCAPTO-2,4-DIMETHYL-1,2,4-TRIAZOLINE-3-THIONE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H7N3S2
InChI InChI=1S/C4H7N3S2/c1-6-3(8)5-7(2)4(6)9/h1-2H3,(H,5,8)
InChIKey UPFWWNKDKAPMSV-UHFFFAOYSA-N
Literature Reference Author S.ERNST,C.RICHTER,A.HOBERT,G.G.MARIAM,K.SCHULZE
Literature Reference Citation J.HETCYCL.CHEM.,32,275(1995)
Literature Reference DOI 10.1002/jhet.5570320147
Molecular Weight 161.240 g/mol
Solvent CDCl3
Source File Reference UWMZ3127