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

4
Annotation Hits: 0
References: 1408
Patents: 298.15286 Da
Monoisotopic Mass: -0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	299.160136	182.3
[M+Na]+	321.142078	190.2
[M-H]-	297.145584	190.5
[M+NH4]+	316.186683	185.7
[M+K]+	337.116018	189.9
[M+H-H2O]+	281.150120	176.5
[M+HCOO]-	343.151061	195.2
[M+CH3COO]-	357.166711	212.5
[M+Na-2H]-	319.127526	180.7
[M]+	298.15231142	191.5
[M]-	298.15340858	191.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe