CID 137887638

5-bromo-6-chloro-4-methylpyridine-3-sulfonamide

Structural Information

Molecular Formula
C6H6BrClN2O2S
SMILES
CC1=C(C(=NC=C1S(=O)(=O)N)Cl)Br
InChI
InChI=1S/C6H6BrClN2O2S/c1-3-4(13(9,11)12)2-10-6(8)5(3)7/h2H,1H3,(H2,9,11,12)
InChIKey
RMFDSEJAUKDXHJ-UHFFFAOYSA-N
Compound name
5-bromo-6-chloro-4-methylpyridine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.9022 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.90948 137.4
[M+Na]+ 306.89142 152.7
[M-H]- 282.89492 143.4
[M+NH4]+ 301.93602 157.3
[M+K]+ 322.86536 138.7
[M+H-H2O]+ 266.89946 138.4
[M+HCOO]- 328.90040 149.5
[M+CH3COO]- 342.91605 192.8
[M+Na-2H]- 304.87687 143.6
[M]+ 283.90165 159.3
[M]- 283.90275 159.3
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

No patent data available for this compound.