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.alpha.-D-Glucopyranoside, 1,6-bis-O-(2,2-dimethyl-1-oxopropyl)-.beta.-D-fructofuranosyl, 6-(2,2-dimethylpropanoate)
SpectraBase Compound ID CPFbAupf09V
InChI InChI=1S/C27H46O14/c1-24(2,3)21(33)36-10-13-15(28)17(30)18(31)20(39-13)41-27(12-38-23(35)26(7,8)9)19(32)16(29)14(40-27)11-37-22(34)25(4,5)6/h13-20,28-32H,10-12H2,1-9H3/t13-,14-,15-,16-,17+,18-,19+,20-,27-/m1/s1
InChIKey NIRMWKHNLDJUMZ-UPVGJWLLSA-N
Mol Weight 594.7 g/mol
Molecular Formula C27H46O14
Exact Mass 594.288756 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Je0817qjdw5
Name .alpha.-D-Glucopyranoside, 1,6-bis-O-(2,2-dimethyl-1-oxopropyl)-.beta.-D-fructofuranosyl, 6-(2,2-dimethylpropanoate)
CAS Registry Number 90634-03-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H46O14
InChI InChI=1S/C27H46O14/c1-24(2,3)21(33)36-10-13-15(28)17(30)18(31)20(39-13)41-27(12-38-23(35)26(7,8)9)19(32)16(29)14(40-27)11-37-22(34)25(4,5)6/h13-20,28-32H,10-12H2,1-9H3/t13-,14-,15-,16-,17+,18-,19+,20-,27-/m1/s1
InChIKey NIRMWKHNLDJUMZ-UPVGJWLLSA-N
Molecular Weight 594.651 g/mol
SMILES O[C@]1([C@@]([C@@](O[C@@]2([C@@]([C@]([C@@]([C@](O2)(COC(C(C)(C)C)=O)[H])(O)[H])(O)[H])(O)[H])[H])(O[C@@]1(COC(C(C)(C)C)=O)[H])COC(C(C)(C)C)=O)(O)[H])[H]
SPLASH splash10-0a4i-9141200000-806925320e5ce33c5d74
Source of Spectrum KC-1984-427-0
Synonyms 1,6-bis-O-(2,2-dimethylpropanoyl)-.alpha.-D-arabino-hex-2-ulofuranosyl 6-O-(2,2-dimethylpropanoyl)-.alpha.-D-glucopyranoside 1,6-Di-O-pivaloyl.beta.-D-fructofuranosyl 6-O-pivaloyl.alpha.-D-glucopyranoside
Wiley ID 1409601