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5-(PARA-TOLUYLAMINO)-2H-1,2,4-THIADIAZOL-3-ONE
SpectraBase Compound ID IiCXGjYxCGN
InChI InChI=1S/C10H9N3O2S/c1-6-2-4-7(5-3-6)8(14)11-10-12-9(15)13-16-10/h2-5H,1H3,(H2,11,12,13,14,15)
InChIKey PDIPGVXTKUKGCS-UHFFFAOYSA-N
Mol Weight 235.26 g/mol
Molecular Formula C10H9N3O2S
Exact Mass 235.041548 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BSNVq3M6uPF
Name 5-(PARA-TOLUYLAMINO)-2H-1,2,4-THIADIAZOL-3-ONE
Compound Number 3G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H9N3O2S
InChI InChI=1S/C10H9N3O2S/c1-6-2-4-7(5-3-6)8(14)11-10-12-9(15)13-16-10/h2-5H,1H3,(H2,11,12,13,14,15)
InChIKey PDIPGVXTKUKGCS-UHFFFAOYSA-N
Literature Reference Author N.S.CHO,H.I.SHON,C.PARKANYI
Literature Reference Citation J.HETCYCL.CHEM.,28,1725(1991)
Literature Reference DOI 10.1002/jhet.5570280714
Molecular Weight 235.260 g/mol
Solvent DMSO-D6
Source File Reference UWCP3570