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Sucrose, 6-o-trityl-2,3,4,1',3',4',6'-hepta-o-acetyl-
SpectraBase Compound ID 68t5oxCGvro
InChI InChI=1S/C45H50O18/c1-26(46)53-23-37-39(57-29(4)49)42(60-32(7)52)44(62-37,25-54-27(2)47)63-43-41(59-31(6)51)40(58-30(5)50)38(56-28(3)48)36(61-43)24-55-45(33-17-11-8-12-18-33,34-19-13-9-14-20-34)35-21-15-10-16-22-35/h8-22,36-43H,23-25H2,1-7H3
InChIKey MIRJEFNFCVLFOM-UHFFFAOYSA-N
Mol Weight 878.9 g/mol
Molecular Formula C45H50O18
Exact Mass 878.299715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K8n8foYUoh9
Name Sucrose, 6-o-trityl-2,3,4,1',3',4',6'-hepta-o-acetyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 878.299714752 u
Formula C45H50O18
InChI InChI=1S/C45H50O18/c1-26(46)53-23-37-39(57-29(4)49)42(60-32(7)52)44(62-37,25-54-27(2)47)63-43-41(59-31(6)51)40(58-30(5)50)38(56-28(3)48)36(61-43)24-55-45(33-17-11-8-12-18-33,34-19-13-9-14-20-34)35-21-15-10-16-22-35/h8-22,36-43H,23-25H2,1-7H3
InChIKey MIRJEFNFCVLFOM-UHFFFAOYSA-N
Molecular Weight 878.877 g/mol
SMILES C1(C(C(COC(=O)C)(OC2OC(C(C(C2OC(C)=O)OC(C)=O)OC(C)=O)COC(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)OC1COC(=O)C)OC(C)=O)OC(C)=O