CID 56956192

2-bromopyridine-3-sulfonyl chloride

Structural Information

Molecular Formula
C5H3BrClNO2S
SMILES
C1=CC(=C(N=C1)Br)S(=O)(=O)Cl
InChI
InChI=1S/C5H3BrClNO2S/c6-5-4(11(7,9)10)2-1-3-8-5/h1-3H
InChIKey
XJPBDTIFSUZVAK-UHFFFAOYSA-N
Compound name
2-bromopyridine-3-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

254.87564 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.88292 130.8
[M+Na]+ 277.86486 135.2
[M+NH4]+ 272.90946 135.8
[M+K]+ 293.83880 134.4
[M-H]- 253.86836 130.3
[M+Na-2H]- 275.85031 135.1
[M]+ 254.87509 130.8
[M]- 254.87619 130.8
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