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3,3-DIMETHYL-5-METHYLTHIO-1,2,4-TRIAZOLINE-5 HYDROIODIDE
SpectraBase Compound ID 22oyOXCZy5U
InChI InChI=1S/C5H11N3S.HI/c1-5(2)6-4(9-3)7-8-5;/h8H,1-3H3,(H,6,7);1H
InChIKey LMBAPCCNJRQEIN-UHFFFAOYSA-N
Mol Weight 273.14 g/mol
Molecular Formula C5H12IN3S
Exact Mass 272.979664 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ffdPca2Y3C
Name 3,3-DIMETHYL-5-METHYLTHIO-1,2,4-TRIAZOLINE-5 HYDROIODIDE
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Formula C5H12IN3S
InChI InChI=1S/C5H11N3S.HI/c1-5(2)6-4(9-3)7-8-5;/h8H,1-3H3,(H,6,7);1H
InChIKey LMBAPCCNJRQEIN-UHFFFAOYSA-N
Instrument Name Tesla BS497
Literature Reference K.N.ZELENIN, O.B.KUZNETSOVA, V.V.ALEKSEEV, V.P.SERGUTINA, P.B.TERENT'EV,V.V.OVCHARENKO (1991) Khim.Heteroc.Soed.(Russ. Lang.): N11, 1515-1520.
NMR Standard HMDS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6SO dimethylsulfo