CID 522584

Ethanesulfonyl fluoride

Structural Information

Molecular Formula
C2H5FO2S
SMILES
CCS(=O)(=O)F
InChI
InChI=1S/C2H5FO2S/c1-2-6(3,4)5/h2H2,1H3
InChIKey
OIBMEBLCOQCFIT-UHFFFAOYSA-N
Compound name
ethanesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

945
Patents

111.99943 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 113.006706 114.0
[M+Na]+ 134.988648 123.8
[M-H]- 110.992154 114.0
[M+NH4]+ 130.033253 137.4
[M+K]+ 150.962588 123.2
[M+H-H2O]+ 94.996690 109.5
[M+HCOO]- 156.997631 131.9
[M+CH3COO]- 171.013281 164.2
[M+Na-2H]- 132.974096 119.6
[M]+ 111.99888142 115.7
[M]- 111.99997858 115.7
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