CID 16058

Etoglucid

Structural Information

Molecular Formula
C12H22O6
SMILES
C1C(O1)COCCOCCOCCOCC2CO2
InChI
InChI=1S/C12H22O6/c1(13-3-5-15-7-11-9-17-11)2-14-4-6-16-8-12-10-18-12/h11-12H,1-10H2
InChIKey
UMILHIMHKXVDGH-UHFFFAOYSA-N
Compound name
2-[2-[2-[2-(oxiran-2-ylmethoxy)ethoxy]ethoxy]ethoxymethyl]oxirane
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

79
References

37651
Patents

262.14163 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.14891 139.6
[M+Na]+ 285.13085 150.0
[M+NH4]+ 280.17545 146.1
[M+K]+ 301.10479 150.0
[M-H]- 261.13435 154.1
[M+Na-2H]- 283.11630 148.0
[M]+ 262.14108 146.9
[M]- 262.14218 146.9
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