CID 145371405

3-(1,1-difluoroethyl)-2-fluoropyridine

Structural Information

Molecular Formula
C7H6F3N
SMILES
CC(C1=C(N=CC=C1)F)(F)F
InChI
InChI=1S/C7H6F3N/c1-7(9,10)5-3-2-4-11-6(5)8/h2-4H,1H3
InChIKey
INFDKVAKLAJWCE-UHFFFAOYSA-N
Compound name
3-(1,1-difluoroethyl)-2-fluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

161.04523 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.05251 135.0
[M+Na]+ 184.03445 145.4
[M+NH4]+ 179.07905 141.4
[M+K]+ 200.00839 139.8
[M-H]- 160.03795 132.3
[M+Na-2H]- 182.01990 140.5
[M]+ 161.04468 135.5
[M]- 161.04578 135.5
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

No patent data available for this compound.