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5-Chloro-3-phenyl-1,3,4-thiadiazol-2(3H)-one
SpectraBase Compound ID KjLVJbP5ECd
InChI InChI=1S/C8H5ClN2OS/c9-7-10-11(8(12)13-7)6-4-2-1-3-5-6/h1-5H
InChIKey KUGJHWTWFZIFCV-UHFFFAOYSA-N
Mol Weight 212.65 g/mol
Molecular Formula C8H5ClN2OS
Exact Mass 211.981112 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EJllr5Qb0VF
Name 5-Chloro-3-phenyl-1,3,4-thiadiazol-2(3H)-one
CAS Registry Number 59166-37-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H5ClN2OS
InChI InChI=1S/C8H5ClN2OS/c9-7-10-11(8(12)13-7)6-4-2-1-3-5-6/h1-5H
InChIKey KUGJHWTWFZIFCV-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference U. Anthoni, B. Mynster Dahl, H. Eggert, Acta Chem. Scand. B30, 71 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3