CID 154828522

5-bromo-1h-indazole-3-sulfonamide

Structural Information

Molecular Formula
C7H6BrN3O2S
SMILES
C1=CC2=NNC(=C2C=C1Br)S(=O)(=O)N
InChI
InChI=1S/C7H6BrN3O2S/c8-4-1-2-6-5(3-4)7(11-10-6)14(9,12)13/h1-3H,(H,10,11)(H2,9,12,13)
InChIKey
FGSKFWOJCQSXFL-UHFFFAOYSA-N
Compound name
5-bromo-2H-indazole-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.9364 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.94368 140.4
[M+Na]+ 297.92562 155.8
[M-H]- 273.92912 145.0
[M+NH4]+ 292.97022 160.6
[M+K]+ 313.89956 142.8
[M+H-H2O]+ 257.93366 141.1
[M+HCOO]- 319.93460 156.3
[M+CH3COO]- 333.95025 188.6
[M+Na-2H]- 295.91107 148.4
[M]+ 274.93585 160.8
[M]- 274.93695 160.8
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

No patent data available for this compound.