CID 10773304

4,5-dichloropyridin-2-amine

Structural Information

Molecular Formula
C5H4Cl2N2
SMILES
C1=C(C(=CN=C1N)Cl)Cl
InChI
InChI=1S/C5H4Cl2N2/c6-3-1-5(8)9-2-4(3)7/h1-2H,(H2,8,9)
InChIKey
CRRAQLWJVYODCL-UHFFFAOYSA-N
Compound name
4,5-dichloropyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

227
Patents

161.97516 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.98244 126.5
[M+Na]+ 184.96438 137.6
[M-H]- 160.96788 128.2
[M+NH4]+ 180.00898 147.0
[M+K]+ 200.93832 132.8
[M+H-H2O]+ 144.97242 122.2
[M+HCOO]- 206.97336 141.6
[M+CH3COO]- 220.98901 177.0
[M+Na-2H]- 182.94983 133.4
[M]+ 161.97461 127.2
[M]- 161.97571 127.2
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