CID 60622998

2,3-difluoro-4-(difluoromethyl)pyridine

Structural Information

Molecular Formula
C6H3F4N
SMILES
C1=CN=C(C(=C1C(F)F)F)F
InChI
InChI=1S/C6H3F4N/c7-4-3(5(8)9)1-2-11-6(4)10/h1-2,5H
InChIKey
BEKMBPQQOARBLZ-UHFFFAOYSA-N
Compound name
4-(difluoromethyl)-2,3-difluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

165.02016 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.02744 137.2
[M+Na]+ 188.00938 146.4
[M+NH4]+ 183.05398 142.5
[M+K]+ 203.98332 141.1
[M-H]- 164.01288 133.4
[M+Na-2H]- 185.99483 141.2
[M]+ 165.01961 137.1
[M]- 165.02071 137.1
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