CID 165913814

2-bromo-n,n-dimethylpyridine-4-sulfonamide

Structural Information

Molecular Formula
C7H9BrN2O2S
SMILES
CN(C)S(=O)(=O)C1=CC(=NC=C1)Br
InChI
InChI=1S/C7H9BrN2O2S/c1-10(2)13(11,12)6-3-4-9-7(8)5-6/h3-5H,1-2H3
InChIKey
VDYQEXDNPJJBGA-UHFFFAOYSA-N
Compound name
2-bromo-N,N-dimethylpyridine-4-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.95682 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.964096 136.4
[M+Na]+ 286.946038 149.2
[M-H]- 262.949544 143.5
[M+NH4]+ 281.990643 156.7
[M+K]+ 302.919978 138.5
[M+H-H2O]+ 246.954080 136.0
[M+HCOO]- 308.955021 153.7
[M+CH3COO]- 322.970671 193.6
[M+Na-2H]- 284.931486 144.1
[M]+ 263.95627142 158.5
[M]- 263.95736858 158.5
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.