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2-O-METHYLBENZAMIDO-3H-1,3,4-THIADIAZOLE-2-THIONE
SpectraBase Compound ID 8r55NQ60p9K
InChI InChI=1S/C10H9N3OS2/c1-6-4-2-3-5-7(6)8(14)11-9-12-13-10(15)16-9/h2-5H,1H3,(H,13,15)(H,11,12,14)
InChIKey CUSJVNUTTPTXTH-UHFFFAOYSA-N
Mol Weight 251.32 g/mol
Molecular Formula C10H9N3OS2
Exact Mass 251.018704 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FxeNw3wFMNr
Name 2-O-METHYLBENZAMIDO-3H-1,3,4-THIADIAZOLE-2-THIONE
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H9N3OS2
InChI InChI=1S/C10H9N3OS2/c1-6-4-2-3-5-7(6)8(14)11-9-12-13-10(15)16-9/h2-5H,1H3,(H,13,15)(H,11,12,14)
InChIKey CUSJVNUTTPTXTH-UHFFFAOYSA-N
Literature Reference Author N.S.CHO,G.N.KIM,C.PARKANYI
Literature Reference Citation J.HETCYCL.CHEM.,30,397(1993)
Literature Reference DOI 10.1002/jhet.5570300219
Molecular Weight 251.321 g/mol
Solvent DMSO-D6
Source File Reference UWPB215