CID 820700

2-amino-5-bromobenzenesulfonamide

Structural Information

Molecular Formula
C6H7BrN2O2S
SMILES
C1=CC(=C(C=C1Br)S(=O)(=O)N)N
InChI
InChI=1S/C6H7BrN2O2S/c7-4-1-2-5(8)6(3-4)12(9,10)11/h1-3H,8H2,(H2,9,10,11)
InChIKey
BGILQOXCWMHWOM-UHFFFAOYSA-N
Compound name
2-amino-5-bromobenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

90
Patents

249.94116 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.94844 134.3
[M+Na]+ 272.93038 146.8
[M-H]- 248.93388 140.2
[M+NH4]+ 267.97498 154.7
[M+K]+ 288.90432 133.8
[M+H-H2O]+ 232.93842 133.6
[M+HCOO]- 294.93936 151.9
[M+CH3COO]- 308.95501 189.8
[M+Na-2H]- 270.91583 140.4
[M]+ 249.94061 151.7
[M]- 249.94171 151.7
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