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NEOPENTYL-[3-(3,5-DICHLOROPHENYL)-PHENYL]-DIFLUOROMETHANESULFONATE
SpectraBase Compound ID 1PmruDhEYdA
InChI InChI=1S/C18H18Cl2F2O3S/c1-17(2,3)11-25-26(23,24)18(21,22)14-6-4-5-12(7-14)13-8-15(19)10-16(20)9-13/h4-10H,11H2,1-3H3
InChIKey CLFIJYHKDCCIGU-UHFFFAOYSA-N
Mol Weight 423.3 g/mol
Molecular Formula C18H18Cl2F2O3S
Exact Mass 422.032177 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8HCD0OoLsqr
Name NEOPENTYL-[3-(3,5-DICHLOROPHENYL)-PHENYL]-DIFLUOROMETHANESULFONATE
Compound Number 79
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18Cl2F2O3S
InChI InChI=1S/C18H18Cl2F2O3S/c1-17(2,3)11-25-26(23,24)18(21,22)14-6-4-5-12(7-14)13-8-15(19)10-16(20)9-13/h4-10H,11H2,1-3H3
InChIKey CLFIJYHKDCCIGU-UHFFFAOYSA-N
Literature Reference Author C.LEUNG,J.GRZYB,J.LEE,N.MEYER,G.HUM,C.JIA,S.LIU,S.D.TAYLOR
Literature Reference Citation BIOORG.MED.CHEM.,10,2309(2002)
Literature Reference DOI 10.1016/S0968-0896(02)00062-7
Solvent CDCl3
Source File Reference UWVN28533