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1-(3-FLUOROPHENETHYL)-3-(5-CHLORO-1,3-DIMETHYL-1H-PYRAZOLE-4-CARBONYL)-THIOUREA

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1-(3-FLUOROPHENETHYL)-3-(5-CHLORO-1,3-DIMETHYL-1H-PYRAZOLE-4-CARBONYL)-THIOUREA
SpectraBase Compound ID JDmAlGSVdqs
InChI InChI=1S/C15H16ClFN4OS/c1-9-12(13(16)21(2)20-9)14(22)19-15(23)18-7-6-10-4-3-5-11(17)8-10/h3-5,8H,6-7H2,1-2H3,(H2,18,19,22,23)
InChIKey BWUZLAZVXPKFOX-UHFFFAOYSA-N
Mol Weight 354.83 g/mol
Molecular Formula C15H16ClFN4OS
Exact Mass 354.071738 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1GBk1y1R0tO
Name 1-(3-FLUOROPHENETHYL)-3-(5-CHLORO-1,3-DIMETHYL-1H-PYRAZOLE-4-CARBONYL)-THIOUREA
Compound Number 6I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H16ClFN4OS
InChI InChI=1S/C15H16ClFN4OS/c1-9-12(13(16)21(2)20-9)14(22)19-15(23)18-7-6-10-4-3-5-11(17)8-10/h3-5,8H,6-7H2,1-2H3,(H2,18,19,22,23)
InChIKey BWUZLAZVXPKFOX-UHFFFAOYSA-N
Literature Reference Author J.WU,Q.SHI,Z.CHEN,M.HE,L.JIN,D.HU
Literature Reference Citation MOLECULES,17,5139(2012)
Literature Reference DOI 10.3390/molecules17055139
Solvent CDCl3
Source File Reference UWIR1069