CID 84762812

2-(difluoromethyl)pyridin-4-amine

Structural Information

Molecular Formula
C6H6F2N2
SMILES
C1=CN=C(C=C1N)C(F)F
InChI
InChI=1S/C6H6F2N2/c7-6(8)5-3-4(9)1-2-10-5/h1-3,6H,(H2,9,10)
InChIKey
FLIYJBILJRGCLE-UHFFFAOYSA-N
Compound name
2-(difluoromethyl)pyridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

158
Patents

144.04991 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.057186 124.2
[M+Na]+ 167.039128 132.9
[M-H]- 143.042634 123.8
[M+NH4]+ 162.083733 143.9
[M+K]+ 183.013068 130.8
[M+H-H2O]+ 127.047170 116.3
[M+HCOO]- 189.048111 145.8
[M+CH3COO]- 203.063761 176.4
[M+Na-2H]- 165.024576 130.3
[M]+ 144.04936142 119.3
[M]- 144.05045858 119.3
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

patents stripe