CID 61461216

1-[2-(1h-imidazol-1-yl)ethyl]imidazolidine-2,4,5-trione hydrochloride

Structural Information

Molecular Formula
C8H8N4O3
SMILES
C1=CN(C=N1)CCN2C(=O)C(=O)NC2=O
InChI
InChI=1S/C8H8N4O3/c13-6-7(14)12(8(15)10-6)4-3-11-2-1-9-5-11/h1-2,5H,3-4H2,(H,10,13,15)
InChIKey
LXKXWMGJOIDAGQ-UHFFFAOYSA-N
Compound name
1-(2-imidazol-1-ylethyl)imidazolidine-2,4,5-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.05965 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.066926 143.3
[M+Na]+ 231.048868 153.0
[M-H]- 207.052374 144.2
[M+NH4]+ 226.093473 159.4
[M+K]+ 247.022808 150.2
[M+H-H2O]+ 191.056910 134.9
[M+HCOO]- 253.057851 162.6
[M+CH3COO]- 267.073501 180.9
[M+Na-2H]- 229.034316 144.3
[M]+ 208.05910142 142.4
[M]- 208.06019858 142.4
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.