CID 24701375

2-bromo-n-hydroxybenzamide

Structural Information

Molecular Formula
C7H6BrNO2
SMILES
C1=CC=C(C(=C1)C(=O)NO)Br
InChI
InChI=1S/C7H6BrNO2/c8-6-4-2-1-3-5(6)7(10)9-11/h1-4,11H,(H,9,10)
InChIKey
AZPGONYSPBZNAZ-UHFFFAOYSA-N
Compound name
2-bromo-N-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

10
Patents

214.95819 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.96547 135.2
[M+Na]+ 237.94741 145.9
[M-H]- 213.95091 140.4
[M+NH4]+ 232.99201 156.2
[M+K]+ 253.92135 135.0
[M+H-H2O]+ 197.95545 134.9
[M+HCOO]- 259.95639 156.8
[M+CH3COO]- 273.97204 182.5
[M+Na-2H]- 235.93286 143.0
[M]+ 214.95764 152.0
[M]- 214.95874 152.0
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