CID 155973390

2-fluoro-3-(2-fluoropropan-2-yl)pyridine

Structural Information

Molecular Formula
C8H9F2N
SMILES
CC(C)(C1=C(N=CC=C1)F)F
InChI
InChI=1S/C8H9F2N/c1-8(2,10)6-4-3-5-11-7(6)9/h3-5H,1-2H3
InChIKey
HRFMCRSIPBJASX-UHFFFAOYSA-N
Compound name
2-fluoro-3-(2-fluoropropan-2-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.07031 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.077586 128.6
[M+Na]+ 180.059528 138.0
[M-H]- 156.063034 128.8
[M+NH4]+ 175.104133 148.7
[M+K]+ 196.033468 135.9
[M+H-H2O]+ 140.067570 121.3
[M+HCOO]- 202.068511 148.6
[M+CH3COO]- 216.084161 178.0
[M+Na-2H]- 178.044976 136.3
[M]+ 157.06976142 126.3
[M]- 157.07085858 126.3
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.