CID 23236375

2-chloro-6-(1,2,2,2-tetrafluoroethyl)pyridine

Structural Information

Molecular Formula
C7H4ClF4N
SMILES
C1=CC(=NC(=C1)Cl)C(C(F)(F)F)F
InChI
InChI=1S/C7H4ClF4N/c8-5-3-1-2-4(13-5)6(9)7(10,11)12/h1-3,6H
InChIKey
UUFWEBZPYLMDJL-UHFFFAOYSA-N
Compound name
2-chloro-6-(1,2,2,2-tetrafluoroethyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.99684 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.00412 133.5
[M+Na]+ 235.98606 143.9
[M-H]- 211.98956 130.9
[M+NH4]+ 231.03066 151.9
[M+K]+ 251.96000 139.6
[M+H-H2O]+ 195.99410 125.0
[M+HCOO]- 257.99504 146.1
[M+CH3COO]- 272.01069 184.6
[M+Na-2H]- 233.97151 138.9
[M]+ 212.99629 129.7
[M]- 212.99739 129.7
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.