CID 88571719

3,3,3-trifluoro-n-methylpropane-1-sulfonamide

Structural Information

Molecular Formula
C4H8F3NO2S
SMILES
CNS(=O)(=O)CCC(F)(F)F
InChI
InChI=1S/C4H8F3NO2S/c1-8-11(9,10)3-2-4(5,6)7/h8H,2-3H2,1H3
InChIKey
XYHFKSLCAPHXSB-UHFFFAOYSA-N
Compound name
3,3,3-trifluoro-N-methylpropane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.02278 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.03006 142.2
[M+Na]+ 214.01200 147.5
[M+NH4]+ 209.05660 146.5
[M+K]+ 229.98594 142.8
[M-H]- 190.01550 136.0
[M+Na-2H]- 211.99745 142.5
[M]+ 191.02223 141.1
[M]- 191.02333 141.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.