CID 142580

Methanedisulfonyl fluoride

Structural Information

Molecular Formula
CH2F2O4S2
SMILES
C(S(=O)(=O)F)S(=O)(=O)F
InChI
InChI=1S/CH2F2O4S2/c2-8(4,5)1-9(3,6)7/h1H2
InChIKey
DKWGSLVGHONKMY-UHFFFAOYSA-N
Compound name
methanedisulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

120
Patents

179.93626 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.94354 126.0
[M+Na]+ 202.92548 135.9
[M-H]- 178.92898 124.2
[M+NH4]+ 197.97008 146.0
[M+K]+ 218.89942 133.3
[M+H-H2O]+ 162.93352 120.1
[M+HCOO]- 224.93446 136.5
[M+CH3COO]- 238.95011 171.8
[M+Na-2H]- 200.91093 130.0
[M]+ 179.93571 127.4
[M]- 179.93681 127.4
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