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(-)-(1S,3R,5R)-3-FLUORO-8,8-DIMETHYL-8-AZONIA-BICYCLO-[3.2.1]-OCTAN-2-ONE-TRIFLUOROMETHANESULFONATE
SpectraBase Compound ID GaCR9hQeGhz
InChI InChI=1S/C9H15FNO.CHF3O3S/c1-11(2)6-3-4-8(11)9(12)7(10)5-6;2-1(3,4)8(5,6)7/h6-8H,3-5H2,1-2H3;(H,5,6,7)/q+1;/p-1/t6-,7-,8+;/m1./s1
InChIKey UXBXCSVKAOCUQU-LRACWOHVSA-M
Mol Weight 321.29 g/mol
Molecular Formula C10H15F4NO4S
Exact Mass 321.065792 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LVMV5UERaHL
Name (-)-(1S,3R,5R)-3-FLUORO-8,8-DIMETHYL-8-AZONIA-BICYCLO-[3.2.1]-OCTAN-2-ONE-TRIFLUOROMETHANESULFONATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H15F4NO4S
InChI InChI=1S/C9H15FNO.CHF3O3S/c1-11(2)6-3-4-8(11)9(12)7(10)5-6;2-1(3,4)8(5,6)7/h6-8H,3-5H2,1-2H3;(H,5,6,7)/q+1;/p-1/t6-,7-,8+;/m1./s1
InChIKey UXBXCSVKAOCUQU-LRACWOHVSA-M
Literature Reference Author S.E.DENMARK,H.MATSUHASHI
Literature Reference Citation J.ORG.CHEM.,67,3479(2002)
Literature Reference DOI 10.1021/jo020050h
Solvent CD3CN
Source File Reference UWLU25665