6-O-(2-Methylbutanoyl)-α-D-glucopyranosyl α-D-glucopyranoside

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Systematic / IUPAC Name: {(2R,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl}methyl 2-methylbutanoate

ID: Reference8004

Other Names: α-D-Glucopyranoside, 6-O-(2-methyl-1-oxobutyl)-α-D-glucopyranosyl

Formula: C17H30O12

Spectral Data

6-O-(2-Methylbutanoyl)-α-D-glucopyranosyl α-D-glucopyranoside mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 288
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 5/28/2018 10:18:11 AM
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Identificators

InChI InChI=1S/C17H30O12/c1-3-6(2)15(25)26-5-8-10(20)12(22)14(24)17(28-8)29-16-13(23)11(21)9(19)7(4-18)27-16/h6-14,16-24H,3-5H2,1-2H3/t6?,7-,8-,9-,10-,11+,12+,13-,14-,16-,17-/m1/s1
InChI Key XLVGCFIBECZCKR-NVGKCVISSA-N
Canonical SMILES CCC(C)C(=O)OCC1C(C(C(C(O1)OC2C(C(C(C(O2)CO)O)O)O)O)O)O
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Other Names α-D-Glucopyranoside, 6-O-(2-methyl-1-oxobutyl)-α-D-glucopyranosyl

In Other Databases

ChemSpider 29814830
PubChem 75368747