CID 74070253

Mdl 19205

Structural Information

Molecular Formula
C11H13N3O2
SMILES
CCC1C(NC(=O)N1)C(=O)C2=CC=NC=C2
InChI
InChI=1S/C11H13N3O2/c1-2-8-9(14-11(16)13-8)10(15)7-3-5-12-6-4-7/h3-6,8-9H,2H2,1H3,(H2,13,14,16)
InChIKey
WJBHKYQDAXROOK-UHFFFAOYSA-N
Compound name
4-ethyl-5-(pyridine-4-carbonyl)imidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

60
References

0
Patents

219.10077 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.10805 149.9
[M+Na]+ 242.08999 156.8
[M-H]- 218.09349 149.8
[M+NH4]+ 237.13459 164.3
[M+K]+ 258.06393 152.4
[M+H-H2O]+ 202.09803 141.5
[M+HCOO]- 264.09897 165.9
[M+CH3COO]- 278.11462 182.4
[M+Na-2H]- 240.07544 151.2
[M]+ 219.10022 145.2
[M]- 219.10132 145.2
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

No patent data available for this compound.