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6,6-DIMETHYL-5-OXOCYCLOHEX-1-ENYL-TRIFLUOROMETHANESULPHONATE
SpectraBase Compound ID 3KAVjlLkz53
InChI InChI=1S/C9H11F3O4S/c1-8(2)6(13)4-3-5-7(8)16-17(14,15)9(10,11)12/h5H,3-4H2,1-2H3
InChIKey RNCKHCPLRPPXJN-UHFFFAOYSA-N
Mol Weight 272.24 g/mol
Molecular Formula C9H11F3O4S
Exact Mass 272.033014 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BTHMeI5dZbZ
Name 6,6-DIMETHYL-5-OXOCYCLOHEX-1-ENYL-TRIFLUOROMETHANESULPHONATE
Compound Number 11A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H11F3O4S
InChI InChI=1S/C9H11F3O4S/c1-8(2)6(13)4-3-5-7(8)16-17(14,15)9(10,11)12/h5H,3-4H2,1-2H3
InChIKey RNCKHCPLRPPXJN-UHFFFAOYSA-N
Literature Reference Author D.S.D.MIRANDA,G.J.A.D.CONCEICAO,J.ZUKERMAN-SCHPECTOR,M.C.GUE RRERO,U.SCHUCHARDT,A
Literature Reference Citation J.BRAZ.CHEM.SOC.,12,391(2001)
Literature Reference DOI 10.1590/s0103-50532001000300011
Molecular Weight 272.239 g/mol
Solvent CDCl3
Source File Reference UWPA1353