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1,4,3,6-dianhydro-D-mannitol, di-p-toluenesulfonate
SpectraBase Compound ID Bk5PUQUznMf
InChI InChI=1S/C20H22O8S2/c1-13-3-7-15(8-4-13)29(21,22)27-17-11-25-20-18(12-26-19(17)20)28-30(23,24)16-9-5-14(2)6-10-16/h3-10,17-20H,11-12H2,1-2H3/t17-,18-,19-,20-/m1/s1
InChIKey LFXDGKWHPSDRCT-UAFMIMERSA-N
Mol Weight 454.51 g/mol
Molecular Formula C20H22O8S2
Exact Mass 454.07561 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 65fvleiJ6Fy
Name 1,4:3,6-DIANHYDRO-D-MANNITOL, DI-p-TOLUENESULFONATE
Source of Sample J. Bakos, University of Chemical Engineering, Veszprem, Hungary
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O8S2
InChI InChI=1S/C20H22O8S2/c1-13-3-7-15(8-4-13)29(21,22)27-17-11-25-20-18(12-26-19(17)20)28-30(23,24)16-9-5-14(2)6-10-16/h3-10,17-20H,11-12H2,1-2H3/t17-,18-,19-,20-/m1/s1
InChIKey LFXDGKWHPSDRCT-UAFMIMERSA-N
Melting Point 89-91C
Molecular Weight 454.52
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20