CID 48781

66968-67-0

Structural Information

Molecular Formula
C9H14N2O4
SMILES
CCC1(C(=O)NC(=O)NC1=O)CCOC
InChI
InChI=1S/C9H14N2O4/c1-3-9(4-5-15-2)6(12)10-8(14)11-7(9)13/h3-5H2,1-2H3,(H2,10,11,12,13,14)
InChIKey
RJIIPBSBMRJYAR-UHFFFAOYSA-N
Compound name
5-ethyl-5-(2-methoxyethyl)-1,3-diazinane-2,4,6-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.09535 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.102626 145.5
[M+Na]+ 237.084568 153.3
[M-H]- 213.088074 143.6
[M+NH4]+ 232.129173 162.2
[M+K]+ 253.058508 150.7
[M+H-H2O]+ 197.092610 139.8
[M+HCOO]- 259.093551 161.4
[M+CH3COO]- 273.109201 181.6
[M+Na-2H]- 235.070016 149.1
[M]+ 214.09480142 143.6
[M]- 214.09589858 143.6
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

No patent data available for this compound.