CID 21893426

Fluoromethanesulfonamide

Structural Information

Molecular Formula
CH4FNO2S
SMILES
C(F)S(=O)(=O)N
InChI
InChI=1S/CH4FNO2S/c2-1-6(3,4)5/h1H2,(H2,3,4,5)
InChIKey
HGFAGBHAGYXJKZ-UHFFFAOYSA-N
Compound name
fluoromethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

516
Patents

112.994675 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.00195 114.3
[M+Na]+ 135.98389 123.4
[M-H]- 111.98740 113.6
[M+NH4]+ 131.02850 136.8
[M+K]+ 151.95783 122.3
[M+H-H2O]+ 95.991935 109.2
[M+HCOO]- 157.99288 132.6
[M+CH3COO]- 172.00853 165.2
[M+Na-2H]- 133.96934 119.5
[M]+ 112.99413 113.5
[M]- 112.99522 113.5
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