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Benzyl 2,5-Di-O-acetyl-.alpha.-D-glucofuranosidurono-6,3-lactone
SpectraBase Compound ID KfqtLcuXexG
InChI InChI=1S/C17H18O8/c1-9(18)22-14-12-13(24-16(14)20)15(23-10(2)19)17(25-12)21-8-11-6-4-3-5-7-11/h3-7,12-15,17H,8H2,1-2H3/t12-,13-,14-,15+,17-/m0/s1
InChIKey QLMJTCSALDCLGD-JGFGOLAASA-N
Mol Weight 350.32 g/mol
Molecular Formula C17H18O8
Exact Mass 350.100168 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BXYSov3J0FA
Name Benzyl 2,5-Di-O-acetyl-.alpha.-D-glucofuranosidurono-6,3-lactone
Alternate Name(s) (3S,3aS,5S,6R,6aS)-6-(acetyloxy)-5-(benzyloxy)-2-oxo-hexahydrofuro[3,2-b]furan-3-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O8
InChI InChI=1S/C17H18O8/c1-9(18)22-14-12-13(24-16(14)20)15(23-10(2)19)17(25-12)21-8-11-6-4-3-5-7-11/h3-7,12-15,17H,8H2,1-2H3/t12-,13-,14-,15+,17-/m0/s1
InChIKey QLMJTCSALDCLGD-JGFGOLAASA-N
Molecular Weight 350.323 g/mol
SMILES [C@@]12([C@@]([C@](OC(=O)C)(C(O2)=O)[H])(O[C@@]([C@@]1(OC(=O)C)[H])(OCc1ccccc1)[H])[H])[H]
SPLASH splash10-000x-0590000000-37e460e5b8cb0d749880
Source of Spectrum J-63-2107-36
Wiley ID 1341801