CID 2512552

2-(2,5-dioxoimidazolidin-1-yl)acetic acid

Structural Information

Molecular Formula
C5H6N2O4
SMILES
C1C(=O)N(C(=O)N1)CC(=O)O
InChI
InChI=1S/C5H6N2O4/c8-3-1-6-5(11)7(3)2-4(9)10/h1-2H2,(H,6,11)(H,9,10)
InChIKey
UYBPMPGSEWRTLG-UHFFFAOYSA-N
Compound name
2-(2,5-dioxoimidazolidin-1-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

70
Patents

158.03276 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.04004 129.3
[M+Na]+ 181.02198 137.6
[M-H]- 157.02548 127.8
[M+NH4]+ 176.06658 147.7
[M+K]+ 196.99592 136.0
[M+H-H2O]+ 141.03002 123.4
[M+HCOO]- 203.03096 147.7
[M+CH3COO]- 217.04661 169.2
[M+Na-2H]- 179.00743 131.7
[M]+ 158.03221 126.6
[M]- 158.03331 126.6
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