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2-(3-CHLORO-4-METHYLPHENYLAMINO)-5-(2,4-DIHYDROXYPHENYL)-1,3,4-THIADIAZOLE

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2-(3-CHLORO-4-METHYLPHENYLAMINO)-5-(2,4-DIHYDROXYPHENYL)-1,3,4-THIADIAZOLE
SpectraBase Compound ID LjWkl8880MZ
InChI InChI=1S/C15H12ClN3O2S/c1-8-2-3-9(6-12(8)16)17-15-19-18-14(22-15)11-5-4-10(20)7-13(11)21/h2-7,20-21H,1H3,(H,17,19)
InChIKey OAKQBQNWOMURHK-UHFFFAOYSA-N
Mol Weight 333.79 g/mol
Molecular Formula C15H12ClN3O2S
Exact Mass 333.033876 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1OOcRfv5hwQ
Name 2-(3-CHLORO-4-METHYLPHENYLAMINO)-5-(2,4-DIHYDROXYPHENYL)-1,3,4-THIADIAZOLE
Compound Number X
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H12ClN3O2S
InChI InChI=1S/C15H12ClN3O2S/c1-8-2-3-9(6-12(8)16)17-15-19-18-14(22-15)11-5-4-10(20)7-13(11)21/h2-7,20-21H,1H3,(H,17,19)
InChIKey OAKQBQNWOMURHK-UHFFFAOYSA-N
Literature Reference Author J.MATYSIAK
Literature Reference Citation CHEM.PHARM.BULL.,54,988(2006)
Literature Reference DOI 10.1248/cpb.54.988
Molecular Weight 333.792 g/mol
Sample ID 37187
Solvent DMSO-D6