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(1S,2S,5R)-5-METHYL-1-TRIFLUOROMETHYL-2-[(METHYLPHENYL)-SULFINYL]-6,8-DIOXABICYCLO-[3.2.1]-OCTANE
SpectraBase Compound ID 9gYWaD5SmF8
InChI InChI=1S/C15H17F3O3S/c1-10-3-5-11(6-4-10)22(19)12-7-8-13(2)20-9-14(12,21-13)15(16,17)18/h3-6,12H,7-9H2,1-2H3/t12-,13+,14+,22?/m0/s1
InChIKey FWURXPNTBVJGAX-NWJYKLHGSA-N
Mol Weight 334.35 g/mol
Molecular Formula C15H17F3O3S
Exact Mass 334.08505 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GvvyyhiC7AW
Name (1S,2S,5R)-5-METHYL-1-TRIFLUOROMETHYL-2-[(METHYLPHENYL)-SULFINYL]-6,8-DIOXABICYCLO-[3.2.1]-OCTANE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H17F3O3S
InChI InChI=1S/C15H17F3O3S/c1-10-3-5-11(6-4-10)22(19)12-7-8-13(2)20-9-14(12,21-13)15(16,17)18/h3-6,12H,7-9H2,1-2H3/t12-,13+,14+,22?/m0/s1
InChIKey FWURXPNTBVJGAX-NWJYKLHGSA-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 334.353 g/mol
Solvent CDCl3
Source File Reference UWLU29077