CID 693267

2-amino-3-chloropyridine

Structural Information

Molecular Formula
C5H5ClN2
SMILES
C1=CC(=C(N=C1)N)Cl
InChI
InChI=1S/C5H5ClN2/c6-4-2-1-3-8-5(4)7/h1-3H,(H2,7,8)
InChIKey
RZJPBQGRCNJYBU-UHFFFAOYSA-N
Compound name
3-chloropyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

1282
Patents

128.01413 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.021406 120.4
[M+Na]+ 151.003348 130.4
[M-H]- 127.006854 122.6
[M+NH4]+ 146.047953 141.7
[M+K]+ 166.977288 127.0
[M+H-H2O]+ 111.011390 115.3
[M+HCOO]- 173.012331 140.8
[M+CH3COO]- 187.027981 170.9
[M+Na-2H]- 148.988796 128.9
[M]+ 128.01358142 119.8
[M]- 128.01467858 119.8
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