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(2S,3R)-1-BENZYL-1-[(ETHOXYCARBONYL)-METHYL]-3-PHENYL-2-VINYLAZETIDINIUM-TRIFLUOROMETHANESULFONATE

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(2S,3R)-1-BENZYL-1-[(ETHOXYCARBONYL)-METHYL]-3-PHENYL-2-VINYLAZETIDINIUM-TRIFLUOROMETHANESULFONATE
SpectraBase Compound ID 16xxLDydAW2
InChI InChI=1S/C22H26NO2.CHF3O3S/c1-3-21-20(19-13-9-6-10-14-19)16-23(21,17-22(24)25-4-2)15-18-11-7-5-8-12-18;2-1(3,4)8(5,6)7/h3,5-14,20-21H,1,4,15-17H2,2H3;(H,5,6,7)/q+1;/p-1/t20-,21-,23?;/m0./s1
InChIKey CESSBVURSLHONS-FHSMYXGISA-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 9MT6kKk4sL4
Name (2S,3R)-1-BENZYL-1-[(ETHOXYCARBONYL)-METHYL]-3-PHENYL-2-VINYLAZETIDINIUM-TRIFLUOROMETHANESULFONATE
Compound Number 28
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H26F3NO5S
InChI InChI=1S/C22H26NO2.CHF3O3S/c1-3-21-20(19-13-9-6-10-14-19)16-23(21,17-22(24)25-4-2)15-18-11-7-5-8-12-18;2-1(3,4)8(5,6)7/h3,5-14,20-21H,1,4,15-17H2,2H3;(H,5,6,7)/q+1;/p-1/t20-,21-,23?;/m0./s1
InChIKey CESSBVURSLHONS-FHSMYXGISA-M
Literature Reference Author F.COUTY,F.DURRAT,G.EVANO,J.MARROT
Literature Reference Citation EUR.J.ORG.CHEM.,4214(2006)
Molecular Weight 485.518 g/mol
Sample ID 32824
Solvent Unknown