CID 115030022

2-(3-fluorophenyl)propane-1-sulfonamide

Structural Information

Molecular Formula
C9H12FNO2S
SMILES
CC(CS(=O)(=O)N)C1=CC(=CC=C1)F
InChI
InChI=1S/C9H12FNO2S/c1-7(6-14(11,12)13)8-3-2-4-9(10)5-8/h2-5,7H,6H2,1H3,(H2,11,12,13)
InChIKey
GECLCEKRULIFPA-UHFFFAOYSA-N
Compound name
2-(3-fluorophenyl)propane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.05728 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.06456 145.5
[M+Na]+ 240.04650 155.0
[M+NH4]+ 235.09110 152.4
[M+K]+ 256.02044 148.7
[M-H]- 216.05000 145.2
[M+Na-2H]- 238.03195 149.9
[M]+ 217.05673 147.0
[M]- 217.05783 147.0
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.