CID 67805

Chloromethanesulfonyl fluoride

Structural Information

Molecular Formula
CH2ClFO2S
SMILES
C(S(=O)(=O)F)Cl
InChI
InChI=1S/CH2ClFO2S/c2-1-6(3,4)5/h1H2
InChIKey
CRUSUKQDRLFRHO-UHFFFAOYSA-N
Compound name
chloromethanesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

7
Patents

131.94481 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.95209 114.3
[M+Na]+ 154.93403 125.0
[M-H]- 130.93753 114.5
[M+NH4]+ 149.97863 137.7
[M+K]+ 170.90797 122.7
[M+H-H2O]+ 114.94207 111.0
[M+HCOO]- 176.94301 128.0
[M+CH3COO]- 190.95866 165.2
[M+Na-2H]- 152.91948 120.0
[M]+ 131.94426 117.2
[M]- 131.94536 117.2
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