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4,4-dideuteriooxy-1,1-dimethylpiperidin-1-ium; trifluoromethanesulfonate
SpectraBase Compound ID BDAzSJJQqxB
InChI InChI=1S/C7H16NO2.CHF3O3S/c1-8(2)5-3-7(9,10)4-6-8;2-1(3,4)8(5,6)7/h9-10H,3-6H2,1-2H3;(H,5,6,7)/q+1;/p-1/i9D,10D;
InChIKey OTYNGICEJLBCKK-AVDPWCIQSA-M
Mol Weight 297.29 g/mol
Molecular Formula C8H142H2F3NO5S
Exact Mass 297.082682 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2E8UeCzstJp
Name 4,4-dideuteriooxy-1,1-dimethylpiperidin-1-ium; trifluoromethanesulfonate
Compound Number 3A
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Formula C8H142H2F3NO5S
InChI InChI=1S/C7H16NO2.CHF3O3S/c1-8(2)5-3-7(9,10)4-6-8;2-1(3,4)8(5,6)7/h9-10H,3-6H2,1-2H3;(H,5,6,7)/q+1;/p-1/i9D,10D;
InChIKey OTYNGICEJLBCKK-AVDPWCIQSA-M
Literature Reference Author D.YANG,Y.C.YIP,G.S.JIAO,M.K.WONG
Literature Reference Citation J.ORG.CHEM.,63,8952(1998)
Literature Reference DOI 10.1021/jo981270r
Molecular Weight 297.286 g/mol
Sample ID 26525
Solvent CD3CN:D2O