CID 4416192

54931-11-2

Structural Information

Molecular Formula
C5H6N2O
SMILES
C1=CC(=O)N(C=C1)N
InChI
InChI=1S/C5H6N2O/c6-7-4-2-1-3-5(7)8/h1-4H,6H2
InChIKey
JADBQNNRRQRIFM-UHFFFAOYSA-N
Compound name
1-aminopyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

153
Patents

110.04801 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.05529 116.5
[M+Na]+ 133.03723 126.1
[M-H]- 109.04073 119.1
[M+NH4]+ 128.08183 137.7
[M+K]+ 149.01117 124.5
[M+H-H2O]+ 93.045270 110.6
[M+HCOO]- 155.04621 142.0
[M+CH3COO]- 169.06186 168.2
[M+Na-2H]- 131.02268 125.5
[M]+ 110.04746 114.9
[M]- 110.04856 114.9
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