CID 68034

2-fluoroethyl methanesulfonate

Structural Information

Molecular Formula
C3H7FO3S
SMILES
CS(=O)(=O)OCCF
InChI
InChI=1S/C3H7FO3S/c1-8(5,6)7-3-2-4/h2-3H2,1H3
InChIKey
DLFIXPTUMHDGCB-UHFFFAOYSA-N
Compound name
2-fluoroethyl methanesulfonate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

325
Patents

142.01 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.01728 121.9
[M+Na]+ 164.99922 131.1
[M-H]- 141.00272 121.7
[M+NH4]+ 160.04382 144.0
[M+K]+ 180.97316 130.6
[M+H-H2O]+ 125.00726 117.0
[M+HCOO]- 187.00820 139.7
[M+CH3COO]- 201.02385 169.3
[M+Na-2H]- 162.98467 127.1
[M]+ 142.00945 125.4
[M]- 142.01055 125.4
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