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1-o-Benzoyl-4,6-dideoxy-3,5-o-isopropylidene-2-o-(methoxymethyl)-D-glucitol

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

1-o-Benzoyl-4,6-dideoxy-3,5-o-isopropylidene-2-o-(methoxymethyl)-D-glucitol
SpectraBase Compound ID 11H353mRMNf
InChI InChI=1S/C18H26O6/c1-13-10-15(24-18(2,3)23-13)16(22-12-20-4)11-21-17(19)14-8-6-5-7-9-14/h5-9,13,15-16H,10-12H2,1-4H3/t13-,15+,16+/m1/s1
InChIKey IULIZRNAUUCSAN-KBMXLJTQSA-N
Mol Weight 338.4 g/mol
Molecular Formula C18H26O6
Exact Mass 338.172939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AzGuVv9SBpd
Name 1-o-Benzoyl-4,6-dideoxy-3,5-o-isopropylidene-2-o-(methoxymethyl)-D-glucitol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 338.172938551 u
Formula C18H26O6
InChI InChI=1S/C18H26O6/c1-13-10-15(24-18(2,3)23-13)16(22-12-20-4)11-21-17(19)14-8-6-5-7-9-14/h5-9,13,15-16H,10-12H2,1-4H3/t13-,15+,16+/m1/s1
InChIKey IULIZRNAUUCSAN-KBMXLJTQSA-N
Molecular Weight 338.400 g/mol
SMILES C1(O[C@]([C@](COC(=O)C2=CC=CC=C2)(OCOC)[H])(C[C@](O1)(C)[H])[H])(C)C