CID 64408379

2-(4-fluorobenzenesulfonamido)ethanimidamide hydrochloride

Structural Information

Molecular Formula
C8H10FN3O2S
SMILES
C1=CC(=CC=C1F)S(=O)(=O)NCC(=N)N
InChI
InChI=1S/C8H10FN3O2S/c9-6-1-3-7(4-2-6)15(13,14)12-5-8(10)11/h1-4,12H,5H2,(H3,10,11)
InChIKey
RTGTWUMENFHCAU-UHFFFAOYSA-N
Compound name
2-[(4-fluorophenyl)sulfonylamino]ethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.04778 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.05506 144.8
[M+Na]+ 254.03700 151.5
[M-H]- 230.04050 146.6
[M+NH4]+ 249.08160 161.6
[M+K]+ 270.01094 147.6
[M+H-H2O]+ 214.04504 137.2
[M+HCOO]- 276.04598 163.7
[M+CH3COO]- 290.06163 193.1
[M+Na-2H]- 252.02245 148.8
[M]+ 231.04723 141.8
[M]- 231.04833 141.8
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.