CID 67282570

4-(difluoromethyl)pyridin-2-amine

Structural Information

Molecular Formula
C6H6F2N2
SMILES
C1=CN=C(C=C1C(F)F)N
InChI
InChI=1S/C6H6F2N2/c7-6(8)4-1-2-10-5(9)3-4/h1-3,6H,(H2,9,10)
InChIKey
CXNARPJWYBRIKJ-UHFFFAOYSA-N
Compound name
4-(difluoromethyl)pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

176
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

literature stripe

Patent stripe

patents stripe