For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2-Deoxy-2-fluoro-3,4,6-tri-o-pivaloyl-beta-1-(cyclohexyl)-D-glucopyranose

View entire compound with spectra: 2 NMR

2-Deoxy-2-fluoro-3,4,6-tri-o-pivaloyl-beta-1-(cyclohexyl)-D-glucopyranose
SpectraBase Compound ID 30TNn6OsLg9
InChI InChI=1S/C27H45FO8/c1-25(2,3)22(29)32-15-17-19(35-23(30)26(4,5)6)20(36-24(31)27(7,8)9)18(28)21(34-17)33-16-13-11-10-12-14-16/h16-21H,10-15H2,1-9H3/t17-,18-,19-,20-,21+/m1/s1
InChIKey DMYMIVDMIDUCHJ-ONUIULTDSA-N
Mol Weight 516.6 g/mol
Molecular Formula C27H45FO8
Exact Mass 516.309847 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID yekTemuGPN
Name 2-Deoxy-2-fluoro-3,4,6-tri-o-pivaloyl-beta-1-(cyclohexyl)-D-glucopyranose
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 516.309846564 u
Formula C27H45FO8
InChI InChI=1S/C27H45FO8/c1-25(2,3)22(29)32-15-17-19(35-23(30)26(4,5)6)20(36-24(31)27(7,8)9)18(28)21(34-17)33-16-13-11-10-12-14-16/h16-21H,10-15H2,1-9H3/t17-,18-,19-,20-,21+/m1/s1
InChIKey DMYMIVDMIDUCHJ-ONUIULTDSA-N
Molecular Weight 516.647 g/mol
SMILES [C@@]1(F)([C@](O[C@@]([C@]([C@@]1(OC(=O)C(C)(C)C)[H])(OC(=O)C(C)(C)C)[H])(COC(=O)C(C)(C)C)[H])(OC1CCCCC1)[H])[H]