CID 91539998

3-fluoro-5-methoxypyridin-2-ol

Structural Information

Molecular Formula
C6H6FNO2
SMILES
COC1=CNC(=O)C(=C1)F
InChI
InChI=1S/C6H6FNO2/c1-10-4-2-5(7)6(9)8-3-4/h2-3H,1H3,(H,8,9)
InChIKey
AMLBNLHNLFADJG-UHFFFAOYSA-N
Compound name
3-fluoro-5-methoxy-1H-pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

143.03825 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.04553 122.2
[M+Na]+ 166.02747 132.6
[M-H]- 142.03097 122.7
[M+NH4]+ 161.07207 142.1
[M+K]+ 182.00141 130.4
[M+H-H2O]+ 126.03551 115.7
[M+HCOO]- 188.03645 144.5
[M+CH3COO]- 202.05210 170.4
[M+Na-2H]- 164.01292 129.6
[M]+ 143.03770 121.5
[M]- 143.03880 121.5
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