CID 217907

5-fluoro-8-quinolinol

Structural Information

Molecular Formula
C9H6FNO
SMILES
C1=CC2=C(C=CC(=C2N=C1)O)F
InChI
InChI=1S/C9H6FNO/c10-7-3-4-8(12)9-6(7)2-1-5-11-9/h1-5,12H
InChIKey
YHXLEKUJMPEQAJ-UHFFFAOYSA-N
Compound name
5-fluoroquinolin-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

387
Patents

163.04333 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.05061 128.4
[M+Na]+ 186.03255 138.9
[M-H]- 162.03605 129.7
[M+NH4]+ 181.07715 148.6
[M+K]+ 202.00649 135.2
[M+H-H2O]+ 146.04059 121.5
[M+HCOO]- 208.04153 149.3
[M+CH3COO]- 222.05718 142.3
[M+Na-2H]- 184.01800 137.6
[M]+ 163.04278 126.9
[M]- 163.04388 126.9
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