CID 53399572

6-fluoroquinolin-3-ol

Structural Information

Molecular Formula
C9H6FNO
SMILES
C1=CC2=NC=C(C=C2C=C1F)O
InChI
InChI=1S/C9H6FNO/c10-7-1-2-9-6(3-7)4-8(12)5-11-9/h1-5,12H
InChIKey
FUEXQMHPXCXPMM-UHFFFAOYSA-N
Compound name
6-fluoroquinolin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

163.04333 Da
Monoisotopic Mass

2.2
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

No literature data available for this compound.

Patent stripe

patents stripe