CID 13919610

19318-24-2

Structural Information

Molecular Formula
C17H26O11
SMILES
CC(=O)OC[C@@H]([C@H]([C@H]([C@@H](COC(=O)C)OC(=O)C)OC(=O)C)OC)OC(=O)C
InChI
InChI=1S/C17H26O11/c1-9(18)24-7-14(26-11(3)20)16(23-6)17(28-13(5)22)15(27-12(4)21)8-25-10(2)19/h14-17H,7-8H2,1-6H3/t14-,15+,16+,17-/m0/s1
InChIKey
RFZVFYLLLYGOTQ-HZMVEIRTSA-N
Compound name
[(2S,3R,4S,5R)-2,4,5,6-tetraacetyloxy-3-methoxyhexyl] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

406.14752 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.15480 203.5
[M+Na]+ 429.13674 213.7
[M-H]- 405.14024 211.7
[M+NH4]+ 424.18134 223.0
[M+K]+ 445.11068 209.0
[M+H-H2O]+ 389.14478 211.3
[M+HCOO]- 451.14572 203.0
[M+CH3COO]- 465.16137 222.9
[M+Na-2H]- 427.12219 198.9
[M]+ 406.14697 207.0
[M]- 406.14807 207.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.