CID 107447164

6-bromo-8-fluoroquinolin-3-ol

Structural Information

Molecular Formula
C9H5BrFNO
SMILES
C1=C2C=C(C=NC2=C(C=C1Br)F)O
InChI
InChI=1S/C9H5BrFNO/c10-6-1-5-2-7(13)4-12-9(5)8(11)3-6/h1-4,13H
InChIKey
WAPRDYRCXXSGRF-UHFFFAOYSA-N
Compound name
6-bromo-8-fluoroquinolin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.95386 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.96114 140.5
[M+Na]+ 263.94308 154.5
[M-H]- 239.94658 144.7
[M+NH4]+ 258.98768 161.4
[M+K]+ 279.91702 142.4
[M+H-H2O]+ 223.95112 140.0
[M+HCOO]- 285.95206 159.0
[M+CH3COO]- 299.96771 155.7
[M+Na-2H]- 261.92853 149.6
[M]+ 240.95331 158.1
[M]- 240.95441 158.1
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.