CID 3446561

3-aminoimidazolidine-2,4-dione

Structural Information

Molecular Formula
C3H5N3O2
SMILES
C1C(=O)N(C(=O)N1)N
InChI
InChI=1S/C3H5N3O2/c4-6-2(7)1-5-3(6)8/h1,4H2,(H,5,8)
InChIKey
DCROTKUJYXYESN-UHFFFAOYSA-N
Compound name
3-aminoimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

59
Patents

115.03818 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.04546 119.7
[M+Na]+ 138.02740 128.5
[M-H]- 114.03090 119.2
[M+NH4]+ 133.07200 140.2
[M+K]+ 154.00134 127.0
[M+H-H2O]+ 98.035440 113.5
[M+HCOO]- 160.03638 141.0
[M+CH3COO]- 174.05203 165.6
[M+Na-2H]- 136.01285 124.0
[M]+ 115.03763 114.7
[M]- 115.03873 114.7
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

patents stripe