CID 581840

2-fluoro-5-methoxypyrimidine

Structural Information

Molecular Formula
C5H5FN2O
SMILES
COC1=CN=C(N=C1)F
InChI
InChI=1S/C5H5FN2O/c1-9-4-2-7-5(6)8-3-4/h2-3H,1H3
InChIKey
WUUQHVUQKBFFMU-UHFFFAOYSA-N
Compound name
2-fluoro-5-methoxypyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

128.03859 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.04587 119.8
[M+Na]+ 151.02781 129.9
[M-H]- 127.03131 119.9
[M+NH4]+ 146.07241 139.5
[M+K]+ 167.00175 128.9
[M+H-H2O]+ 111.03585 112.2
[M+HCOO]- 173.03679 142.2
[M+CH3COO]- 187.05244 170.5
[M+Na-2H]- 149.01326 129.0
[M]+ 128.03804 120.0
[M]- 128.03914 120.0
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.