CID 84648086

2,3-difluoropyridin-4-amine hydrochloride

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

130.03426 Da
Monoisotopic Mass

0.7
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

literature stripe

Patent stripe

patents stripe