CID 4294570

N-(2-aminoethyl)-4-fluorobenzene-1-sulfonamide hydrochloride

Structural Information

Molecular Formula
C8H11FN2O2S
SMILES
C1=CC(=CC=C1F)S(=O)(=O)NCCN
InChI
InChI=1S/C8H11FN2O2S/c9-7-1-3-8(4-2-7)14(12,13)11-6-5-10/h1-4,11H,5-6,10H2
InChIKey
CJTFAYYPQRBCMV-UHFFFAOYSA-N
Compound name
N-(2-aminoethyl)-4-fluorobenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

218.05252 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.05980 142.1
[M+Na]+ 241.04174 149.9
[M-H]- 217.04524 144.1
[M+NH4]+ 236.08634 160.1
[M+K]+ 257.01568 146.1
[M+H-H2O]+ 201.04978 134.9
[M+HCOO]- 263.05072 161.0
[M+CH3COO]- 277.06637 187.9
[M+Na-2H]- 239.02719 146.7
[M]+ 218.05197 141.3
[M]- 218.05307 141.3
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

patents stripe