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
1
Annotation Hits

0
References

174
Patents

148.0484 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.05568 128.8
[M+Na]+ 171.03762 137.2
[M-H]- 147.04112 124.9
[M+NH4]+ 166.08222 146.7
[M+K]+ 187.01156 134.8
[M+H-H2O]+ 131.04566 123.5
[M+HCOO]- 193.04660 145.1
[M+CH3COO]- 207.06225 163.5
[M+Na-2H]- 169.02307 131.1
[M]+ 148.04785 124.4
[M]- 148.04895 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