CID 2736501

2-fluoro-6-(trifluoromethyl)pyridine

Structural Information

Molecular Formula
C6H3F4N
SMILES
C1=CC(=NC(=C1)F)C(F)(F)F
InChI
InChI=1S/C6H3F4N/c7-5-3-1-2-4(11-5)6(8,9)10/h1-3H
InChIKey
IZOIOCQPMHHDHN-UHFFFAOYSA-N
Compound name
2-fluoro-6-(trifluoromethyl)pyridine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

584
Patents

165.02016 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.02744 125.0
[M+Na]+ 188.00938 135.4
[M-H]- 164.01288 122.7
[M+NH4]+ 183.05398 144.5
[M+K]+ 203.98332 132.8
[M+H-H2O]+ 148.01742 116.1
[M+HCOO]- 210.01836 143.4
[M+CH3COO]- 224.03401 177.0
[M+Na-2H]- 185.99483 132.5
[M]+ 165.01961 119.4
[M]- 165.02071 119.4
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