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5-(2-THIENYL)-1,3,4-3H-THIADIAZOLINE-2-THIONE
SpectraBase Compound ID ldZYZAU1hQ
InChI InChI=1S/C6H4N2S3/c9-6-8-7-5(11-6)4-2-1-3-10-4/h1-3H,(H,8,9)
InChIKey OPZYRKWLFVOZTN-UHFFFAOYSA-N
Mol Weight 200.29 g/mol
Molecular Formula C6H4N2S3
Exact Mass 199.953662 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CMjWtYZHQts
Name 5-(2-THIENYL)-1,3,4-3H-THIADIAZOLINE-2-THIONE
CAS Registry Number 41526-33-4
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H4N2S3
InChI InChI=1S/C6H4N2S3/c9-6-8-7-5(11-6)4-2-1-3-10-4/h1-3H,(H,8,9)
InChIKey OPZYRKWLFVOZTN-UHFFFAOYSA-N
Literature Reference Author J.R.BARTELS-KEITH,M.T.BURGESS,J.M.STEVENSON
Literature Reference Citation J.ORG.CHEM.,42,3725(1977)
Literature Reference DOI 10.1021/jo00443a020
Molecular Weight 200.291 g/mol
Solvent DMSO-D6
Source File Reference UWCS13354