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1,5-ANHYDRO-3-O-BENZYL-2-DEOXY-2-N-TOLUENESULFON-6-O-TOLUENESULFONYL-D-MANNITOL
SpectraBase Compound ID CyjWBveW7U3
InChI InChI=1S/C27H31NO8S2/c1-19-8-12-22(13-9-19)37(30,31)28-24-17-34-25(18-36-38(32,33)23-14-10-20(2)11-15-23)26(29)27(24)35-16-21-6-4-3-5-7-21/h3-15,24-29H,16-18H2,1-2H3/t24-,25-,26-,27-/m1/s1
InChIKey OVFQNPQBNPKMEF-FPCALVHFSA-N
Mol Weight 561.66 g/mol
Molecular Formula C27H31NO8S2
Exact Mass 561.149109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID dHjEjRwG7R
Name 1,5-ANHYDRO-3-O-BENZYL-2-DEOXY-2-N-TOLUENESULFON-6-O-TOLUENESULFONYL-D-MANNITOL
Compound Number 13.2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H31NO8S2
InChI InChI=1S/C27H31NO8S2/c1-19-8-12-22(13-9-19)37(30,31)28-24-17-34-25(18-36-38(32,33)23-14-10-20(2)11-15-23)26(29)27(24)35-16-21-6-4-3-5-7-21/h3-15,24-29H,16-18H2,1-2H3/t24-,25-,26-,27-/m1/s1
InChIKey OVFQNPQBNPKMEF-FPCALVHFSA-N
Literature Reference Author K.S.E.TANAKA,A.J.BENNET
Literature Reference Citation CAN.J.CHEM.,76,431(1998)
Literature Reference DOI 10.1139/cjc-76-4-431
Molecular Weight 561.665 g/mol
Solvent CDCl3
Source File Reference UWKP528