CID 44887002

2-amino-5-chloropyridin-4-ol

Structural Information

Molecular Formula
C5H5ClN2O
SMILES
C1=C(NC=C(C1=O)Cl)N
InChI
InChI=1S/C5H5ClN2O/c6-3-2-8-5(7)1-4(3)9/h1-2H,(H3,7,8,9)
InChIKey
FFQWATRBGHOQBG-UHFFFAOYSA-N
Compound name
2-amino-5-chloro-1H-pyridin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

144.00903 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.016306 123.2
[M+Na]+ 166.998248 134.0
[M-H]- 143.001754 124.5
[M+NH4]+ 162.042853 143.5
[M+K]+ 182.972188 129.6
[M+H-H2O]+ 127.006290 118.6
[M+HCOO]- 189.007231 142.5
[M+CH3COO]- 203.022881 170.7
[M+Na-2H]- 164.983696 130.4
[M]+ 144.00848142 122.0
[M]- 144.00957858 122.0
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