CID 45080006

2,6-difluoropyridin-3-amine

Structural Information

Molecular Formula
C5H4F2N2
SMILES
C1=CC(=NC(=C1N)F)F
InChI
InChI=1S/C5H4F2N2/c6-4-2-1-3(8)5(7)9-4/h1-2H,8H2
InChIKey
TVWPHKCZBQOPBF-UHFFFAOYSA-N
Compound name
2,6-difluoropyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

149
Patents

130.03426 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.041536 119.0
[M+Na]+ 153.023478 129.3
[M-H]- 129.026984 119.1
[M+NH4]+ 148.068083 139.6
[M+K]+ 168.997418 127.0
[M+H-H2O]+ 113.031520 111.5
[M+HCOO]- 175.032461 141.9
[M+CH3COO]- 189.048111 173.6
[M+Na-2H]- 151.008926 126.2
[M]+ 130.03371142 114.7
[M]- 130.03480858 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