CID 15738775

2-fluoro-4,6-dimethylpyrimidine

Structural Information

Molecular Formula
C6H7FN2
SMILES
CC1=CC(=NC(=N1)F)C
InChI
InChI=1S/C6H7FN2/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3
InChIKey
JQWBTFGGAKGQPA-UHFFFAOYSA-N
Compound name
2-fluoro-4,6-dimethylpyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

126.059326 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.06660 120.8
[M+Na]+ 149.04854 131.6
[M-H]- 125.05205 121.2
[M+NH4]+ 144.09315 141.0
[M+K]+ 165.02248 129.9
[M+H-H2O]+ 109.05659 113.6
[M+HCOO]- 171.05753 142.8
[M+CH3COO]- 185.07318 172.7
[M+Na-2H]- 147.03399 128.9
[M]+ 126.05878 120.4
[M]- 126.05987 120.4
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

No patent data available for this compound.