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1,4:3,6-Dianhydro-2,5-di-O-methyl-D-glucitol
SpectraBase Compound ID 1khzfthUHlb
InChI InChI=1S/C8H14O4/c1-9-5-3-11-8-6(10-2)4-12-7(5)8/h5-8H,3-4H2,1-2H3/t5-,6+,7-,8-/m1/s1
InChIKey MEJYDZQQVZJMPP-ULAWRXDQSA-N
Mol Weight 174.2 g/mol
Molecular Formula C8H14O4
Exact Mass 174.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5YyR4r20Ndo
Name 1,4:3,6-Dianhydro-2,5-di-O-methyl-D-glucitol
CAS Registry Number 5306-85-4
Classification Drug permeation enhancer
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 174.089208927 u
Formula C8H14O4
InChI InChI=1S/C8H14O4/c1-9-5-3-11-8-6(10-2)4-12-7(5)8/h5-8H,3-4H2,1-2H3/t5-,6+,7-,8-/m1/s1
InChIKey MEJYDZQQVZJMPP-ULAWRXDQSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 174.196 g/mol
Nominal Mass 174 u
Quality 853
Retention Index 1354
SMILES [C@@]12([C@@]([C@@](CO2)(OC)[H])(OC[C@@]1(OC)[H])[H])[H]
SPLASH splash10-0aor-9200000000-57495f1334deb951caa7
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms DMI 2,5-Dimethylisosorbide Isosorbide dimethylether
Technique GC/MS
Wiley ID DD2024_014274