CID 20796

Ethylene dimethanesulfonate

Structural Information

Molecular Formula
C4H10O6S2
SMILES
CS(=O)(=O)OCCOS(=O)(=O)C
InChI
InChI=1S/C4H10O6S2/c1-11(5,6)9-3-4-10-12(2,7)8/h3-4H2,1-2H3
InChIKey
QSQFARNGNIZGAW-UHFFFAOYSA-N
Compound name
2-methylsulfonyloxyethyl methanesulfonate
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

262
References

930
Patents

217.99188 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.99916 142.2
[M+Na]+ 240.98110 150.4
[M-H]- 216.98460 142.5
[M+NH4]+ 236.02570 160.6
[M+K]+ 256.95504 148.6
[M+H-H2O]+ 200.98914 137.3
[M+HCOO]- 262.99008 154.3
[M+CH3COO]- 277.00573 179.4
[M+Na-2H]- 238.96655 146.5
[M]+ 217.99133 149.8
[M]- 217.99243 149.8
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