CID 53485229

4-fluoropyridin-3-ol hydrochloride

Structural Information

Molecular Formula
C5H4FNO
SMILES
C1=CN=CC(=C1F)O
InChI
InChI=1S/C5H4FNO/c6-4-1-2-7-3-5(4)8/h1-3,8H
InChIKey
QDRZHKUAOGGIPE-UHFFFAOYSA-N
Compound name
4-fluoropyridin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

46
Patents

113.027695 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.034971 115.6
[M+Na]+ 136.016913 125.4
[M-H]- 112.020419 115.9
[M+NH4]+ 131.061518 136.6
[M+K]+ 151.990853 123.6
[M+H-H2O]+ 96.024955 109.4
[M+HCOO]- 158.025896 138.0
[M+CH3COO]- 172.041546 165.0
[M+Na-2H]- 134.002361 124.4
[M]+ 113.02714642 113.4
[M]- 113.02824358 113.4
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