CID 71742507

5-bromo-8-hydroxyquinolin-2(1h)-one

Structural Information

Molecular Formula
C9H6BrNO2
SMILES
C1=CC(=O)NC2=C(C=CC(=C21)Br)O
InChI
InChI=1S/C9H6BrNO2/c10-6-2-3-7(12)9-5(6)1-4-8(13)11-9/h1-4,12H,(H,11,13)
InChIKey
KEMIVCPFBJJSIL-UHFFFAOYSA-N
Compound name
5-bromo-8-hydroxy-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

238.95819 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.96547 139.8
[M+Na]+ 261.94741 144.8
[M+NH4]+ 256.99201 144.6
[M+K]+ 277.92135 144.7
[M-H]- 237.95091 139.9
[M+Na-2H]- 259.93286 143.4
[M]+ 238.95764 139.4
[M]- 238.95874 139.4
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

patents stripe