John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=DwAyKvwyjAj SpectraBase Spectrum ID=2WH9I4KGxtS

(accessed ).
2-[2-(2-CHLOROETHOXY)-ETHOXY]-ETHYL-2,3,4,6-TETRA-O-BENZOYL-ALPHA-D-MANNOPYRANOSIDE
SpectraBase Compound ID DwAyKvwyjAj
InChI InChI=1S/C40H39ClO12/c41-21-22-46-23-24-47-25-26-48-40-35(53-39(45)31-19-11-4-12-20-31)34(52-38(44)30-17-9-3-10-18-30)33(51-37(43)29-15-7-2-8-16-29)32(50-40)27-49-36(42)28-13-5-1-6-14-28/h1-20,32-35,40H,21-27H2/t32-,33-,34+,35+,40+/m0/s1
InChIKey AGLMSSUHTYIDON-UVHYHNITSA-N
Mol Weight 747.2 g/mol
Molecular Formula C40H39ClO12
Exact Mass 746.213005 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2WH9I4KGxtS
Name 2-[2-(2-CHLOROETHOXY)-ETHOXY]-ETHYL-2,3,4,6-TETRA-O-BENZOYL-ALPHA-D-MANNOPYRANOSIDE
Compound Number 27
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H39ClO12
InChI InChI=1S/C40H39ClO12/c41-21-22-46-23-24-47-25-26-48-40-35(53-39(45)31-19-11-4-12-20-31)34(52-38(44)30-17-9-3-10-18-30)33(51-37(43)29-15-7-2-8-16-29)32(50-40)27-49-36(42)28-13-5-1-6-14-28/h1-20,32-35,40H,21-27H2/t32-,33-,34+,35+,40+/m0/s1
InChIKey AGLMSSUHTYIDON-UVHYHNITSA-N
Literature Reference Author R.H.FURNEAUX,Z.PAKULSKI,P.C.TYLER
Literature Reference Citation CAN.J.CHEM.,80,964(2002)
Literature Reference DOI 10.1139/v02-120
Molecular Weight 747.195 g/mol
Solvent CDCl3
Source File Reference UWVN27352
SpectraBase Batch ID Il61aOxj8NG