CID 15567528

83962-06-5

Structural Information

Molecular Formula
C5H8N2O
SMILES
CCC1=CNC(=O)N1
InChI
InChI=1S/C5H8N2O/c1-2-4-3-6-5(8)7-4/h3H,2H2,1H3,(H2,6,7,8)
InChIKey
YNKXUNTWNWDIED-UHFFFAOYSA-N
Compound name
4-ethyl-1,3-dihydroimidazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

69
Patents

112.06366 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 113.07094 120.2
[M+Na]+ 135.05288 129.6
[M-H]- 111.05638 118.9
[M+NH4]+ 130.09748 140.9
[M+K]+ 151.02682 126.9
[M+H-H2O]+ 95.060920 114.3
[M+HCOO]- 157.06186 141.5
[M+CH3COO]- 171.07751 161.7
[M+Na-2H]- 133.03833 126.3
[M]+ 112.06311 117.7
[M]- 112.06421 117.7
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

patents stripe