CID 61911

Dtxsid00885536

Structural Information

Molecular Formula
C14H22N2O5
SMILES
CC(CN1C(=O)C(N(C1=O)CC2CO2)(C)C)OCC3CO3
InChI
InChI=1S/C14H22N2O5/c1-9(19-7-11-8-21-11)4-15-12(17)14(2,3)16(13(15)18)5-10-6-20-10/h9-11H,4-8H2,1-3H3
InChIKey
OQAPYXJOOYQXDV-UHFFFAOYSA-N
Compound name
5,5-dimethyl-3-[2-(oxiran-2-ylmethoxy)propyl]-1-(oxiran-2-ylmethyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

1413
Patents

298.15286 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.16014 182.3
[M+Na]+ 321.14208 190.2
[M-H]- 297.14558 190.5
[M+NH4]+ 316.18668 185.7
[M+K]+ 337.11602 189.9
[M+H-H2O]+ 281.15012 176.5
[M+HCOO]- 343.15106 195.2
[M+CH3COO]- 357.16671 212.5
[M+Na-2H]- 319.12753 180.7
[M]+ 298.15231 191.5
[M]- 298.15341 191.5
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