CID 3746818

52210-90-9

Structural Information

Molecular Formula
C8H9N3O
SMILES
C1CN(C(=O)N1)C2=CC=NC=C2
InChI
InChI=1S/C8H9N3O/c12-8-10-5-6-11(8)7-1-3-9-4-2-7/h1-4H,5-6H2,(H,10,12)
InChIKey
HKCFTGZESMCKJA-UHFFFAOYSA-N
Compound name
1-pyridin-4-ylimidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

842
Patents

163.07455 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.08183 133.6
[M+Na]+ 186.06377 141.4
[M-H]- 162.06727 134.8
[M+NH4]+ 181.10837 150.9
[M+K]+ 202.03771 138.3
[M+H-H2O]+ 146.07181 125.1
[M+HCOO]- 208.07275 152.8
[M+CH3COO]- 222.08840 145.8
[M+Na-2H]- 184.04922 138.8
[M]+ 163.07400 129.2
[M]- 163.07510 129.2
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