CID 43603530

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

Structural Information

Molecular Formula
C8H10ClFN2O2S
SMILES
C1=CC(=C(C=C1Cl)F)S(=O)(=O)NCCN
InChI
InChI=1S/C8H10ClFN2O2S/c9-6-1-2-8(7(10)5-6)15(13,14)12-4-3-11/h1-2,5,12H,3-4,11H2
InChIKey
HTDLTEDBKLQTEO-UHFFFAOYSA-N
Compound name
N-(2-aminoethyl)-4-chloro-2-fluorobenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

252.01355 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.02083 149.0
[M+Na]+ 275.00277 158.8
[M+NH4]+ 270.04737 155.8
[M+K]+ 290.97671 151.8
[M-H]- 251.00627 149.1
[M+Na-2H]- 272.98822 153.7
[M]+ 252.01300 150.9
[M]- 252.01410 150.9
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