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(1R,2S,3R,2'E)-1-BENZYL-2-(2'-ETHOXYCARBONYLVINYL)-1-METHYL-3-PHENYLAZETIDINIUM-TRIFLUOROMETHANESULFONATE
SpectraBase Compound ID ASjraXRkcng
InChI InChI=1S/C22H26NO2.CHF3O3S/c1-3-25-22(24)15-14-21-20(19-12-8-5-9-13-19)17-23(21,2)16-18-10-6-4-7-11-18;2-1(3,4)8(5,6)7/h4-15,20-21H,3,16-17H2,1-2H3;(H,5,6,7)/q+1;/p-1/b15-14+;/t20-,21-,23-;/m0./s1
InChIKey TYYVJSMKYMDPMA-LSULWPFISA-M
Mol Weight 485.52 g/mol
Molecular Formula C23H26F3NO5S
Exact Mass 485.148379 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F5AbUqvElYQ
Name (1R,2S,3R,2'E)-1-BENZYL-2-(2'-ETHOXYCARBONYLVINYL)-1-METHYL-3-PHENYLAZETIDINIUM-TRIFLUOROMETHANESULFONATE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H26F3NO5S
InChI InChI=1S/C22H26NO2.CHF3O3S/c1-3-25-22(24)15-14-21-20(19-12-8-5-9-13-19)17-23(21,2)16-18-10-6-4-7-11-18;2-1(3,4)8(5,6)7/h4-15,20-21H,3,16-17H2,1-2H3;(H,5,6,7)/q+1;/p-1/b15-14+;/t20-,21-,23-;/m0./s1
InChIKey TYYVJSMKYMDPMA-LSULWPFISA-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 485.518 g/mol
Sample ID 32487
Solvent Unknown