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(+/-)-ALPHA,BETA-DIMETHYL-N-BENZOYL-ALPHA-(E)-(2'-FLUORO-2'-BENZENESULFONYL)-VINYLASPARTATE
SpectraBase Compound ID BwwTbixrkaz
InChI InChI=1S/C21H20FNO7S/c1-29-18(24)14-21(20(26)30-2,23-19(25)15-9-5-3-6-10-15)13-17(22)31(27,28)16-11-7-4-8-12-16/h3-13H,14H2,1-2H3,(H,23,25)/b17-13+/t21-/m1/s1
InChIKey MKONUINDKZZULY-RYEVTAHJSA-N
Mol Weight 449.45 g/mol
Molecular Formula C21H20FNO7S
Exact Mass 449.094451 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GimWzSKWJmW
Name (+/-)-ALPHA,BETA-DIMETHYL-N-BENZOYL-ALPHA-(E)-(2'-FLUORO-2'-BENZENESULFONYL)-VINYLASPARTATE
Compound Number 7F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20FNO7S
InChI InChI=1S/C21H20FNO7S/c1-29-18(24)14-21(20(26)30-2,23-19(25)15-9-5-3-6-10-15)13-17(22)31(27,28)16-11-7-4-8-12-16/h3-13H,14H2,1-2H3,(H,23,25)/b17-13+/t21-/m1/s1
InChIKey MKONUINDKZZULY-RYEVTAHJSA-N
Literature Reference Author D.B.BERKOWITZ,R.D.L.SALUD-BEA,W.J.JAHNG
Literature Reference Citation ORG.LETTERS,6,1821(2004)
Literature Reference DOI 10.1021/ol049422u
Solvent CDCl3
Source File Reference UWSI39007