CID 11287838

6-bromopyridine-3-sulfonamide

Structural Information

Molecular Formula
C5H5BrN2O2S
SMILES
C1=CC(=NC=C1S(=O)(=O)N)Br
InChI
InChI=1S/C5H5BrN2O2S/c6-5-2-1-4(3-8-5)11(7,9)10/h1-3H,(H2,7,9,10)
InChIKey
HLXUFFXEZONGGG-UHFFFAOYSA-N
Compound name
6-bromopyridine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

235.9255 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.932776 128.9
[M+Na]+ 258.914718 142.3
[M-H]- 234.918224 134.3
[M+NH4]+ 253.959323 149.3
[M+K]+ 274.888658 130.3
[M+H-H2O]+ 218.922760 128.9
[M+HCOO]- 280.923701 145.7
[M+CH3COO]- 294.939351 184.2
[M+Na-2H]- 256.900166 137.1
[M]+ 235.92495142 148.1
[M]- 235.92604858 148.1
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