CID 73554898

2-fluoro-4-iodo-3,5-dimethylpyridine

Structural Information

Molecular Formula
C7H7FIN
SMILES
CC1=CN=C(C(=C1I)C)F
InChI
InChI=1S/C7H7FIN/c1-4-3-10-7(8)5(2)6(4)9/h3H,1-2H3
InChIKey
CYQKRZFLGRUHEI-UHFFFAOYSA-N
Compound name
2-fluoro-4-iodo-3,5-dimethylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

53
Patents

250.96072 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.96800 129.4
[M+Na]+ 273.94994 133.1
[M-H]- 249.95344 124.5
[M+NH4]+ 268.99454 145.5
[M+K]+ 289.92388 136.9
[M+H-H2O]+ 233.95798 119.5
[M+HCOO]- 295.95892 147.1
[M+CH3COO]- 309.97457 185.7
[M+Na-2H]- 271.93539 124.0
[M]+ 250.96017 126.8
[M]- 250.96127 126.8
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