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1,6-di-o-Benzoyldulcitol

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

1,6-di-o-Benzoyldulcitol
SpectraBase Compound ID 2LsM3noL1If
InChI InChI=1S/C20H22O8/c21-15(11-27-19(25)13-7-3-1-4-8-13)17(23)18(24)16(22)12-28-20(26)14-9-5-2-6-10-14/h1-10,15-18,21-24H,11-12H2/t15-,16+,17+,18-
InChIKey LDFVROHMRYBVGB-FZDBZEDMSA-N
Mol Weight 390.39 g/mol
Molecular Formula C20H22O8
Exact Mass 390.131468 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 27DyG1XZTF0
Name 1,6-di-o-Benzoyldulcitol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 390.131467660 u
Formula C20H22O8
InChI InChI=1S/C20H22O8/c21-15(11-27-19(25)13-7-3-1-4-8-13)17(23)18(24)16(22)12-28-20(26)14-9-5-2-6-10-14/h1-10,15-18,21-24H,11-12H2/t15-,16+,17+,18-
InChIKey LDFVROHMRYBVGB-FZDBZEDMSA-N
Molecular Weight 390.388 g/mol
SMILES [C@@]([C@]([C@@](COC(=O)C=1C=CC=CC1)(O)[H])(O)[H])([C@](COC(=O)C=1C=CC=CC1)(O)[H])(O)[H]