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2,3,5-TRI-O-BENZYL-1,4-DIDEOXY-1,4-[[(2'S,3'S)-2',4'-O-BENZYLIDENE-3'-(SULFOOXY)-BUTYL]-EPISULFONIUMYLIDENE]-D-XYLITOL-INNER-SALT

View entire compound with spectra: 1 NMR

2,3,5-TRI-O-BENZYL-1,4-DIDEOXY-1,4-[[(2'S,3'S)-2',4'-O-BENZYLIDENE-3'-(SULFOOXY)-BUTYL]-EPISULFONIUMYLIDENE]-D-XYLITOL-INNER-SALT
SpectraBase Compound ID 9d48kvFAsyV
InChI InChI=1S/C37H40O9S2/c38-48(39,40)46-32-24-44-37(31-19-11-4-12-20-31)45-33(32)26-47-27-34(42-22-29-15-7-2-8-16-29)36(43-23-30-17-9-3-10-18-30)35(47)25-41-21-28-13-5-1-6-14-28/h1-20,32-37H,21-27H2/t32-,33+,34+,35-,36-,37?,47?/m0/s1
InChIKey ZTEWTEIDCJSDNM-FOCFTBRKSA-N
Mol Weight 692.8 g/mol
Molecular Formula C37H40O9S2
Exact Mass 692.211375 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 26dg2GFF1ER
Name 2,3,5-TRI-O-BENZYL-1,4-DIDEOXY-1,4-[[(2'S,3'S)-2',4'-O-BENZYLIDENE-3'-(SULFOOXY)-BUTYL]-EPISULFONIUMYLIDENE]-D-XYLITOL-INNER-SALT
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H40O9S2
InChI InChI=1S/C37H40O9S2/c38-48(39,40)46-32-24-44-37(31-19-11-4-12-20-31)45-33(32)26-47-27-34(42-22-29-15-7-2-8-16-29)36(43-23-30-17-9-3-10-18-30)35(47)25-41-21-28-13-5-1-6-14-28/h1-20,32-37H,21-27H2/t32-,33+,34+,35-,36-,37?,47?/m0/s1
InChIKey ZTEWTEIDCJSDNM-FOCFTBRKSA-N
Literature Reference Author A.GHAVAMI,B.D.JONSTON,M.D.MADDESS,S.M.CHINAPOO,M.T.JENSEN,B. SVENSSON,B.M.PINTO
Literature Reference Citation CAN.J.CHEM.,80,937(2002)
Literature Reference DOI 10.1139/v02-078
Molecular Weight 692.839 g/mol
Solvent CD2Cl2
Source File Reference UWLU29971