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]+ 241.961136 140.5
[M+Na]+ 263.943078 154.5
[M-H]- 239.946584 144.7
[M+NH4]+ 258.987683 161.4
[M+K]+ 279.917018 142.4
[M+H-H2O]+ 223.951120 140.0
[M+HCOO]- 285.952061 159.0
[M+CH3COO]- 299.967711 155.7
[M+Na-2H]- 261.928526 149.6
[M]+ 240.95331142 158.1
[M]- 240.95440858 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.