CID 21846898

2,4-difluoropyridin-3-amine

Structural Information

Molecular Formula
C5H4F2N2
SMILES
C1=CN=C(C(=C1F)N)F
InChI
InChI=1S/C5H4F2N2/c6-3-1-2-9-5(7)4(3)8/h1-2H,8H2
InChIKey
IHLVIYMPPQXOBK-UHFFFAOYSA-N
Compound name
2,4-difluoropyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

130.03426 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.04154 119.0
[M+Na]+ 153.02348 129.3
[M-H]- 129.02698 119.1
[M+NH4]+ 148.06808 139.6
[M+K]+ 168.99742 127.0
[M+H-H2O]+ 113.03152 111.5
[M+HCOO]- 175.03246 141.9
[M+CH3COO]- 189.04811 173.6
[M+Na-2H]- 151.00893 126.2
[M]+ 130.03371 114.7
[M]- 130.03481 114.7
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

patents stripe