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(THREO)-4,5,6,7,8-PENTA-O-ACETYL-3-DEOXY-D-GLUCO-2-OCTULOSE-DIETHYL-DITHIOKETAL
SpectraBase Compound ID Fotwerptd7f
InChI InChI=1S/C22H36O11S2/c1-8-34-22(12-23,35-9-2)10-18(30-14(4)25)20(32-16(6)27)21(33-17(7)28)19(31-15(5)26)11-29-13(3)24/h18-21,23H,8-12H2,1-7H3/t18-,19+,20+,21-/m0/s1
InChIKey ZCMYPSSXTRUFLQ-BQJUDKOJSA-N
Mol Weight 540.6 g/mol
Molecular Formula C22H36O11S2
Exact Mass 540.169904 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C0QDDrflqbj
Name (THREO)-4,5,6,7,8-PENTA-O-ACETYL-3-DEOXY-D-GLUCO-2-OCTULOSE-DIETHYL-DITHIOKETAL
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H36O11S2
InChI InChI=1S/C22H36O11S2/c1-8-34-22(12-23,35-9-2)10-18(30-14(4)25)20(32-16(6)27)21(33-17(7)28)19(31-15(5)26)11-29-13(3)24/h18-21,23H,8-12H2,1-7H3/t18-,19+,20+,21-/m0/s1
InChIKey ZCMYPSSXTRUFLQ-BQJUDKOJSA-N
Literature Reference Author C.SCHMOELZER,M.FISCHER,W.SCHMID
Literature Reference Citation EUR.J.ORG.CHEM.,2010,4886(2010)
Literature Reference DOI 10.1002/ejoc.201000623
Molecular Weight 540.641 g/mol
Solvent CDCl3
Source File Reference UWLU85941