CID 130094601

5-(difluoromethyl)-6-fluoropyridin-2-amine

Structural Information

Molecular Formula
C6H5F3N2
SMILES
C1=CC(=NC(=C1C(F)F)F)N
InChI
InChI=1S/C6H5F3N2/c7-5(8)3-1-2-4(10)11-6(3)9/h1-2,5H,(H2,10,11)
InChIKey
VTFFXAWIBOEKBS-UHFFFAOYSA-N
Compound name
5-(difluoromethyl)-6-fluoropyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

162.04048 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.04776 126.7
[M+Na]+ 185.02970 136.3
[M-H]- 161.03320 125.3
[M+NH4]+ 180.07430 145.8
[M+K]+ 201.00364 133.7
[M+H-H2O]+ 145.03774 118.0
[M+HCOO]- 207.03868 147.1
[M+CH3COO]- 221.05433 180.4
[M+Na-2H]- 183.01515 131.4
[M]+ 162.03993 120.9
[M]- 162.04103 120.9
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.