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5-HYDROXY-2,2-DIMETHYLPENTYL-(3-BROMOPHENYL)-DIFLUOROMETHANESULFONATE
SpectraBase Compound ID 61LzW3DcPc7
InChI InChI=1S/C14H19BrF2O4S/c1-13(2,7-4-8-18)10-21-22(19,20)14(16,17)11-5-3-6-12(15)9-11/h3,5-6,9,18H,4,7-8,10H2,1-2H3
InChIKey IUTHHULCFLXWNP-UHFFFAOYSA-N
Mol Weight 401.26 g/mol
Molecular Formula C14H19BrF2O4S
Exact Mass 400.01555 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1yxHgkGMOFB
Name 5-HYDROXY-2,2-DIMETHYLPENTYL-(3-BROMOPHENYL)-DIFLUOROMETHANESULFONATE
Compound Number 42
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H19BrF2O4S
InChI InChI=1S/C14H19BrF2O4S/c1-13(2,7-4-8-18)10-21-22(19,20)14(16,17)11-5-3-6-12(15)9-11/h3,5-6,9,18H,4,7-8,10H2,1-2H3
InChIKey IUTHHULCFLXWNP-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 UWVN28515