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(1S,5R)-5-Methyl-1-trifluoromethyl-6,8-dioxabicyclo[3.2.1]octane
SpectraBase Compound ID 4mXtj8fudn2
InChI InChI=1S/C8H11F3O2/c1-6-3-2-4-7(13-6,5-12-6)8(9,10)11/h2-5H2,1H3/t6-,7+/m1/s1
InChIKey CYBZGFGFRVMYRU-RQJHMYQMSA-N
Mol Weight 196.17 g/mol
Molecular Formula C8H11F3O2
Exact Mass 196.071114 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8HyIGtaLwaf
Name (1S,5R)-5-METHYL-1-TRIFLUOROMETHYL-6,8-DIOXABICYCLO-[3.2.1]-OCTANE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H11F3O2
InChI InChI=1S/C8H11F3O2/c1-6-3-2-4-7(13-6,5-12-6)8(9,10)11/h2-5H2,1H3/t6-,7+/m1/s1
InChIKey CYBZGFGFRVMYRU-RQJHMYQMSA-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 196.169 g/mol
Solvent CDCl3
Source File Reference UWLU29080