CID 15513770

(8-fluoroquinolin-3-yl)methanol

Structural Information

Molecular Formula
C10H8FNO
SMILES
C1=CC2=CC(=CN=C2C(=C1)F)CO
InChI
InChI=1S/C10H8FNO/c11-9-3-1-2-8-4-7(6-13)5-12-10(8)9/h1-5,13H,6H2
InChIKey
RQYZPULDRNBNFG-UHFFFAOYSA-N
Compound name
(8-fluoroquinolin-3-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.05899 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.066266 133.2
[M+Na]+ 200.048208 143.2
[M-H]- 176.051714 134.3
[M+NH4]+ 195.092813 152.8
[M+K]+ 216.022148 139.2
[M+H-H2O]+ 160.056250 126.0
[M+HCOO]- 222.057191 153.7
[M+CH3COO]- 236.072841 178.7
[M+Na-2H]- 198.033656 141.8
[M]+ 177.05844142 132.0
[M]- 177.05953858 132.0
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.