CID 70700726

6-chloro-5-(trifluoromethyl)pyridine-3-sulfonamide

Structural Information

Molecular Formula
C6H4ClF3N2O2S
SMILES
C1=C(C=NC(=C1C(F)(F)F)Cl)S(=O)(=O)N
InChI
InChI=1S/C6H4ClF3N2O2S/c7-5-4(6(8,9)10)1-3(2-12-5)15(11,13)14/h1-2H,(H2,11,13,14)
InChIKey
AZUGNASGYNDTNJ-UHFFFAOYSA-N
Compound name
6-chloro-5-(trifluoromethyl)pyridine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

221
Patents

259.9634 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.97068 149.6
[M+Na]+ 282.95262 157.7
[M+NH4]+ 277.99722 154.1
[M+K]+ 298.92656 152.7
[M-H]- 258.95612 145.1
[M+Na-2H]- 280.93807 152.5
[M]+ 259.96285 149.7
[M]- 259.96395 149.7
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