CID 60779916

5-bromo-2-chloropyridine-3-sulfonamide

Structural Information

Molecular Formula
C5H4BrClN2O2S
SMILES
C1=C(C=NC(=C1S(=O)(=O)N)Cl)Br
InChI
InChI=1S/C5H4BrClN2O2S/c6-3-1-4(12(8,10)11)5(7)9-2-3/h1-2H,(H2,8,10,11)
InChIKey
VCJIBCGLYQFTIK-UHFFFAOYSA-N
Compound name
5-bromo-2-chloropyridine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

66
Patents

269.88654 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.89382 133.3
[M+Na]+ 292.87576 148.2
[M-H]- 268.87926 139.1
[M+NH4]+ 287.92036 153.5
[M+K]+ 308.84970 134.5
[M+H-H2O]+ 252.88380 134.3
[M+HCOO]- 314.88474 145.7
[M+CH3COO]- 328.90039 188.9
[M+Na-2H]- 290.86121 140.6
[M]+ 269.88599 154.5
[M]- 269.88709 154.5
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