CID 12383435

3-bromopyridine-2-sulfonamide

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

235.9255 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.93278 128.9
[M+Na]+ 258.91472 142.3
[M-H]- 234.91822 134.3
[M+NH4]+ 253.95932 149.3
[M+K]+ 274.88866 130.3
[M+H-H2O]+ 218.92276 128.9
[M+HCOO]- 280.92370 145.7
[M+CH3COO]- 294.93935 184.2
[M+Na-2H]- 256.90017 137.1
[M]+ 235.92495 148.1
[M]- 235.92605 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