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(2S,3S,4S)-2-ETHOXYCARBONYL-1,1,4-TRIMETHYL-3-PHENYLAZETIDINIUM-TRIFLUOROMETHANESULFONATE
SpectraBase Compound ID 3WFAugmbcWz
InChI InChI=1S/C15H22NO2.CHF3O3S/c1-5-18-15(17)14-13(11(2)16(14,3)4)12-9-7-6-8-10-12;2-1(3,4)8(5,6)7/h6-11,13-14H,5H2,1-4H3;(H,5,6,7)/q+1;/p-1/t11-,13+,14-;/m0./s1
InChIKey CCXDJSLLTIXQCB-SPPVMEGGSA-M
Mol Weight 397.41 g/mol
Molecular Formula C16H22F3NO5S
Exact Mass 397.117078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EXtc16Jl6ck
Name (2S,3S,4S)-2-ETHOXYCARBONYL-1,1,4-TRIMETHYL-3-PHENYLAZETIDINIUM-TRIFLUOROMETHANESULFONATE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22F3NO5S
InChI InChI=1S/C15H22NO2.CHF3O3S/c1-5-18-15(17)14-13(11(2)16(14,3)4)12-9-7-6-8-10-12;2-1(3,4)8(5,6)7/h6-11,13-14H,5H2,1-4H3;(H,5,6,7)/q+1;/p-1/t11-,13+,14-;/m0./s1
InChIKey CCXDJSLLTIXQCB-SPPVMEGGSA-M
Literature Reference Author F.COUTY,O.DAVID,F.DURRAT,G.EVANO,S.LAKHDAR,J.MARROT,M.VARGAS -SANCHEZ
Literature Reference Citation EUR.J.ORG.CHEM.,3479(2006)
Molecular Weight 397.410 g/mol
Sample ID 32489
Solvent Unknown