CID 22208

1,3-dihydroimidazol-2-one

Structural Information

Molecular Formula
C3H4N2O
SMILES
C1=CNC(=O)N1
InChI
InChI=1S/C3H4N2O/c6-3-4-1-2-5-3/h1-2H,(H2,4,5,6)
InChIKey
AICIYIDUYNFPRY-UHFFFAOYSA-N
Compound name
1,3-dihydroimidazol-2-one
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

9
References

9933
Patents

84.032364 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 85.039640 111.3
[M+Na]+ 107.02158 120.6
[M-H]- 83.025088 109.9
[M+NH4]+ 102.06619 132.8
[M+K]+ 122.99552 118.4
[M+H-H2O]+ 67.029624 105.4
[M+HCOO]- 129.03056 133.3
[M+CH3COO]- 143.04622 154.6
[M+Na-2H]- 105.00703 119.2
[M]+ 84.031815 107.7
[M]- 84.032913 107.7
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

No patent data available for this compound.