CID 15169932

3-bromo-4-hydroxybenzamide

Structural Information

Molecular Formula
C7H6BrNO2
SMILES
C1=CC(=C(C=C1C(=O)N)Br)O
InChI
InChI=1S/C7H6BrNO2/c8-5-3-4(7(9)11)1-2-6(5)10/h1-3,10H,(H2,9,11)
InChIKey
BZCPLVCYTINNNM-UHFFFAOYSA-N
Compound name
3-bromo-4-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

71
Patents

214.95819 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.96547 135.4
[M+Na]+ 237.94741 137.8
[M+NH4]+ 232.99201 139.6
[M+K]+ 253.92135 139.1
[M-H]- 213.95091 135.5
[M+Na-2H]- 235.93286 138.2
[M]+ 214.95764 134.4
[M]- 214.95874 134.4
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