CID 15824

1854-26-8

Structural Information

Molecular Formula
C5H10N2O5
SMILES
C(N1C(C(N(C1=O)CO)O)O)O
InChI
InChI=1S/C5H10N2O5/c8-1-6-3(10)4(11)7(2-9)5(6)12/h3-4,8-11H,1-2H2
InChIKey
ZEYUSQVGRCPBPG-UHFFFAOYSA-N
Compound name
4,5-dihydroxy-1,3-bis(hydroxymethyl)imidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

8
References

4966
Patents

178.05898 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.066256 135.1
[M+Na]+ 201.048198 143.8
[M-H]- 177.051704 131.4
[M+NH4]+ 196.092803 152.0
[M+K]+ 217.022138 141.8
[M+H-H2O]+ 161.056240 129.8
[M+HCOO]- 223.057181 151.2
[M+CH3COO]- 237.072831 170.2
[M+Na-2H]- 199.033646 136.4
[M]+ 178.05843142 132.9
[M]- 178.05952858 132.9
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