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.alpha.-D-Glucopyranoside, 6-O-(phenylacetyl)-.beta.-D-fructofuranosyl
SpectraBase Compound ID 9rgQVVLXgk
InChI InChI=1S/C20H28O12/c21-7-11-14(24)16(26)17(27)19(30-11)32-20(9-22)18(28)15(25)12(31-20)8-29-13(23)6-10-4-2-1-3-5-10/h1-5,11-12,14-19,21-22,24-28H,6-9H2/t11-,12-,14-,15-,16+,17-,18+,19-,20-/m1/s1
InChIKey CDWACZSKDBGGBU-VVGLLLNFSA-N
Mol Weight 460.43 g/mol
Molecular Formula C20H28O12
Exact Mass 460.158076 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID huPJttrMMx
Name .alpha.-D-Glucopyranoside, 6-O-(phenylacetyl)-.beta.-D-fructofuranosyl
Alternate Name(s) 1-O-(phenylacetyl)-.beta.-D-lyxo-hex-5-ulofuranosyl .alpha.-D-glucopyranoside 6'-O-acetylfructose
CAS Registry Number 123499-74-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O12
InChI InChI=1S/C20H28O12/c21-7-11-14(24)16(26)17(27)19(30-11)32-20(9-22)18(28)15(25)12(31-20)8-29-13(23)6-10-4-2-1-3-5-10/h1-5,11-12,14-19,21-22,24-28H,6-9H2/t11-,12-,14-,15-,16+,17-,18+,19-,20-/m1/s1
InChIKey CDWACZSKDBGGBU-VVGLLLNFSA-N
Molecular Weight 460.432 g/mol
SMILES O[C@]1([C@@]([C@@](O[C@@]2([C@@]([C@]([C@@]([C@](O2)(CO)[H])(O)[H])(O)[H])(O)[H])[H])(O[C@@]1(COC(=O)Cc1ccccc1)[H])CO)(O)[H])[H]
SPLASH splash10-052f-0309700000-8962637a30b2fe5f9069
Source of Spectrum KC-1989-1060-1
Wiley ID 1390399