CID 95143

Methyl 2,3,4,6-tetra-o-methyl-alpha-d-glucopyranoside

Structural Information

Molecular Formula
C11H22O6
SMILES
COC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC)OC)OC)OC
InChI
InChI=1S/C11H22O6/c1-12-6-7-8(13-2)9(14-3)10(15-4)11(16-5)17-7/h7-11H,6H2,1-5H3/t7-,8-,9+,10-,11+/m1/s1
InChIKey
ZYGZAHUNAGVTEC-NZFPMDFQSA-N
Compound name
(2S,3R,4S,5R,6R)-2,3,4,5-tetramethoxy-6-(methoxymethyl)oxane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

62
Patents

250.14163 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.148906 153.6
[M+Na]+ 273.130848 160.4
[M-H]- 249.134354 157.8
[M+NH4]+ 268.175453 170.2
[M+K]+ 289.104788 163.0
[M+H-H2O]+ 233.138890 147.6
[M+HCOO]- 295.139831 173.5
[M+CH3COO]- 309.155481 195.7
[M+Na-2H]- 271.116296 156.6
[M]+ 250.14108142 161.0
[M]- 250.14217858 161.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe