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(1R)-1-[(1R,2S)-2-METHYL-2-[(4S)-2-THIOXO-1,3-DIOXOLAN-4-YL]-CYCLOBUTYL]-ETHYL-BENZOATE
SpectraBase Compound ID 9Es2EhuQpe7
InChI InChI=1S/C17H20O4S/c1-11(20-15(18)12-6-4-3-5-7-12)13-8-9-17(13,2)14-10-19-16(22)21-14/h3-7,11,13-14H,8-10H2,1-2H3/t11-,13+,14-,17-/m1/s1
InChIKey JZJVZAZZGSTCRK-ABYLEIOUSA-N
Mol Weight 320.4 g/mol
Molecular Formula C17H20O4S
Exact Mass 320.10823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cn8GGcJlAdW
Name (1R)-1-[(1R,2S)-2-METHYL-2-[(4S)-2-THIOXO-1,3-DIOXOLAN-4-YL]-CYCLOBUTYL]-ETHYL-BENZOATE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20O4S
InChI InChI=1S/C17H20O4S/c1-11(20-15(18)12-6-4-3-5-7-12)13-8-9-17(13,2)14-10-19-16(22)21-14/h3-7,11,13-14H,8-10H2,1-2H3/t11-,13+,14-,17-/m1/s1
InChIKey JZJVZAZZGSTCRK-ABYLEIOUSA-N
Literature Reference Author S.PARES,R.ALIBES,M.FIGUEREDO,J.FONT,T.PARELLA
Literature Reference Citation EUR.J.ORG.CHEM.,2012,1404(2012)
Literature Reference DOI 10.1002/ejoc.201101614
Molecular Weight 320.403 g/mol
Solvent CDCl3
Source File Reference UWLU84671