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5-p-toluidino-1,3,4-thiadiazoline-2-thione

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5-p-toluidino-1,3,4-thiadiazoline-2-thione
SpectraBase Compound ID EJvNEgRoSiP
InChI InChI=1S/C9H9N3S2/c1-6-2-4-7(5-3-6)10-8-11-12-9(13)14-8/h2-5H,1H3,(H,10,11)(H,12,13)
InChIKey UDHJCFUNVNFOLP-UHFFFAOYSA-N
Mol Weight 223.31 g/mol
Molecular Formula C9H9N3S2
Exact Mass 223.02379 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7aDCNWlrHlc
Name 5-(PARA-TOLUIDINO)-1,3,4-3H-THIADIAZOLINE-2-THIONE
CAS Registry Number 14731-25-0
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9N3S2
InChI InChI=1S/C9H9N3S2/c1-6-2-4-7(5-3-6)10-8-11-12-9(13)14-8/h2-5H,1H3,(H,10,11)(H,12,13)
InChIKey UDHJCFUNVNFOLP-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 223.311 g/mol
Solvent DMSO-D6
Source File Reference UWCS13350