CID 89364

4,5-dihydroxy-1-(hydroxymethyl)imidazolidin-2-one

Structural Information

Molecular Formula
C4H8N2O4
SMILES
C(N1C(C(NC1=O)O)O)O
InChI
InChI=1S/C4H8N2O4/c7-1-6-3(9)2(8)5-4(6)10/h2-3,7-9H,1H2,(H,5,10)
InChIKey
SYPNXFTUXUIACQ-UHFFFAOYSA-N
Compound name
4,5-dihydroxy-1-(hydroxymethyl)imidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

191
Patents

148.0484 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.055676 128.8
[M+Na]+ 171.037618 137.2
[M-H]- 147.041124 124.9
[M+NH4]+ 166.082223 146.7
[M+K]+ 187.011558 134.8
[M+H-H2O]+ 131.045660 123.5
[M+HCOO]- 193.046601 145.1
[M+CH3COO]- 207.062251 163.5
[M+Na-2H]- 169.023066 131.1
[M]+ 148.04785142 124.4
[M]- 148.04894858 124.4
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

patents stripe