CID 43132044

N-[(3-fluorophenyl)methyl]-n-methylaminosulfonamide

Structural Information

Molecular Formula
C8H11FN2O2S
SMILES
CN(CC1=CC(=CC=C1)F)S(=O)(=O)N
InChI
InChI=1S/C8H11FN2O2S/c1-11(14(10,12)13)6-7-3-2-4-8(9)5-7/h2-5H,6H2,1H3,(H2,10,12,13)
InChIKey
MTNUKOMLMCLFRR-UHFFFAOYSA-N
Compound name
1-fluoro-3-[[methyl(sulfamoyl)amino]methyl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.05252 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.05980 142.4
[M+Na]+ 241.04174 150.3
[M-H]- 217.04524 145.9
[M+NH4]+ 236.08634 161.1
[M+K]+ 257.01568 148.0
[M+H-H2O]+ 201.04978 135.1
[M+HCOO]- 263.05072 161.8
[M+CH3COO]- 277.06637 191.2
[M+Na-2H]- 239.02719 146.3
[M]+ 218.05197 142.8
[M]- 218.05307 142.8
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.