CID 12684258

5-bromopyridine-3-sulfonamide

Structural Information

Molecular Formula
C5H5BrN2O2S
SMILES
C1=C(C=NC=C1Br)S(=O)(=O)N
InChI
InChI=1S/C5H5BrN2O2S/c6-4-1-5(3-8-2-4)11(7,9)10/h1-3H,(H2,7,9,10)
InChIKey
ZJAYGKNATMSZHZ-UHFFFAOYSA-N
Compound name
5-bromopyridine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

323
Patents

235.9255 Da
Monoisotopic Mass

0.1
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

literature stripe

Patent stripe

patents stripe