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

146
Patents

144.04991 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.05719 124.2
[M+Na]+ 167.03913 132.9
[M-H]- 143.04263 123.8
[M+NH4]+ 162.08373 143.9
[M+K]+ 183.01307 130.8
[M+H-H2O]+ 127.04717 116.3
[M+HCOO]- 189.04811 145.8
[M+CH3COO]- 203.06376 176.4
[M+Na-2H]- 165.02458 130.3
[M]+ 144.04936 119.3
[M]- 144.05046 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