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3-methyl-5-sulfanylidene-1,3,4-thiadiazolidin-2-one

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3-methyl-5-sulfanylidene-1,3,4-thiadiazolidin-2-one
SpectraBase Compound ID 250pxeLmycV
InChI InChI=1S/C3H4N2OS2/c1-5-3(6)8-2(7)4-5/h1H3,(H,4,7)
InChIKey QLCMNLKYMHSSFP-UHFFFAOYSA-N
Mol Weight 148.2 g/mol
Molecular Formula C3H4N2OS2
Exact Mass 147.976505 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4I4atwkYZoR
Name 5-Mercapto-3-methyl-1,3,4-thiadiazol-2(3H)-one
CAS Registry Number 59166-31-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C3H4N2OS2
InChI InChI=1S/C3H4N2OS2/c1-5-3(6)8-2(7)4-5/h1H3,(H,4,7)
InChIKey QLCMNLKYMHSSFP-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference U. Anthoni, B. Mynster Dahl, H. Eggert, Acta Chem. Scand. B30, 71 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3