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5-[(4-CHLOROPHENYL)-SULFONYLMETHYL]-[1,3,4]-THIADIAZOLE-2-THIOL
SpectraBase Compound ID 5zUmzIOIg4B
InChI InChI=1S/C9H7ClN2O2S3/c10-6-1-3-7(4-2-6)17(13,14)5-8-11-12-9(15)16-8/h1-4H,5H2,(H,12,15)
InChIKey GHYZEAYFXJQJNK-UHFFFAOYSA-N
Mol Weight 306.8 g/mol
Molecular Formula C9H7ClN2O2S3
Exact Mass 305.935819 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ghzyNk68ab
Name 5-[(4-CHLOROPHENYL)-SULFONYLMETHYL]-[1,3,4]-THIADIAZOLE-2-THIOL
Compound Number 9C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H7ClN2O2S3
InChI InChI=1S/C9H7ClN2O2S3/c10-6-1-3-7(4-2-6)17(13,14)5-8-11-12-9(15)16-8/h1-4H,5H2,(H,12,15)
InChIKey GHYZEAYFXJQJNK-UHFFFAOYSA-N
Literature Reference Author V.PADMAVATHI,P.THRIVENI,B.J.M.REDDY,A.PADMAJA
Literature Reference Citation J.HETCYCL.CHEM.,42,113(2005)
Literature Reference DOI 10.1002/jhet.5570420116
Molecular Weight 306.800 g/mol
Sample ID 42327
Solvent CDCl3