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1-[2-(2-ACETAMIDO-5-METHYLPHENYL)-2,2-DIFLUOROACETYL]-THIOSEMICARBAZIDE
SpectraBase Compound ID KiKGYgCFRV1
InChI InChI=1S/C12H14F2N4O2S/c1-6-3-4-9(16-7(2)19)8(5-6)12(13,14)10(20)17-18-11(15)21/h3-5H,1-2H3,(H,16,19)(H,17,20)(H3,15,18,21)
InChIKey QAARZUCFVNTIOL-UHFFFAOYSA-N
Mol Weight 316.33 g/mol
Molecular Formula C12H14F2N4O2S
Exact Mass 316.080553 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C3lCQSnP6z5
Name 1-[2-(2-ACETAMIDO-5-METHYLPHENYL)-2,2-DIFLUOROACETYL]-THIOSEMICARBAZIDE
Compound Number 45
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14F2N4O2S
InChI InChI=1S/C12H14F2N4O2S/c1-6-3-4-9(16-7(2)19)8(5-6)12(13,14)10(20)17-18-11(15)21/h3-5H,1-2H3,(H,16,19)(H,17,20)(H3,15,18,21)
InChIKey QAARZUCFVNTIOL-UHFFFAOYSA-N
Literature Reference Author N.BOECHAT,W.B.KOVER,M.M.BASTOS,A.C.PINTO,L.C.MACIEL,L.M.U.MA YER,F.S.Q.D.SILVA
Literature Reference Citation J.BRAZ.CHEM.SOC.,19,445(2008)
Literature Reference DOI 10.1590/s0103-50532008000300011
Solvent DMSO-D6
Source File Reference UWIR5206