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(1R,2R,5R)-2-[[(4-METHYLPHENYL)-SULFINYL]-METHYL]-2-FLUORO-5-METHYL-6,8-DIOXABICYCLO-[3.2.1]-OCTANE
SpectraBase Compound ID kiuX0JSvJR
InChI InChI=1S/C15H19FO3S/c1-11-3-5-12(6-4-11)20(17)10-15-9-18-14(2,19-15)8-7-13(15)16/h3-6,13H,7-10H2,1-2H3/t13-,14-,15+,20?/m1/s1
InChIKey FVNFGJLMOFKUCH-HXYJGCDHSA-N
Mol Weight 298.37 g/mol
Molecular Formula C15H19FO3S
Exact Mass 298.103894 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L9b3edadzAG
Name (1R,2R,5R)-2-[[(4-METHYLPHENYL)-SULFINYL]-METHYL]-2-FLUORO-5-METHYL-6,8-DIOXABICYCLO-[3.2.1]-OCTANE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H19FO3S
InChI InChI=1S/C15H19FO3S/c1-11-3-5-12(6-4-11)20(17)10-15-9-18-14(2,19-15)8-7-13(15)16/h3-6,13H,7-10H2,1-2H3/t13-,14-,15+,20?/m1/s1
InChIKey FVNFGJLMOFKUCH-HXYJGCDHSA-N
Literature Reference Author P.AMBROSI,A.ARNONE,P.BRAVO,L.BRUCHE,A.D.CRISTOFARO,V.FRANCAR DI,M.FRIGERIO,E.GATT
Literature Reference Citation J.ORG.CHEM.,66,8336(2001)
Literature Reference DOI 10.1021/jo0055640
Molecular Weight 298.372 g/mol
Solvent CDCl3
Source File Reference UWLU29089