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6-THIO-2H-1,3,5-THIADIAZINE-2,4,6(3H,5H)-TRIONE
SpectraBase Compound ID 3KROweUTI8Z
InChI InChI=1S/C3H2N2O2S2/c6-1-4-2(7)9-3(8)5-1/h(H2,4,5,6,7,8)
InChIKey KTCNKXGSWSEDQX-UHFFFAOYSA-N
Mol Weight 162.18 g/mol
Molecular Formula C3H2N2O2S2
Exact Mass 161.95577 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fcqf651Hk40
Name 6-THIO-2H-1,3,5-THIADIAZINE-2,4,6(3H,5H)-TRIONE
Source of Sample R. Rupprecht, W. Bremser BASF Ludwigshafen (1981)
CAS Registry Number 78476-44-5
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C3H2N2O2S2
InChI InChI=1S/C3H2N2O2S2/c6-1-4-2(7)9-3(8)5-1/h(H2,4,5,6,7,8)
InChIKey KTCNKXGSWSEDQX-UHFFFAOYSA-N
Molecular Weight 162.19
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WM-360
Synonyms THIADIAZINE-2,4,6/3H,5H/-TRIONE, 2H-1,3,5-, 6-THIO-,