CID 240445

Bis(morpholin-4-yl)ethane-1,2-dione

Structural Information

Molecular Formula
C10H16N2O4
SMILES
C1COCCN1C(=O)C(=O)N2CCOCC2
InChI
InChI=1S/C10H16N2O4/c13-9(11-1-5-15-6-2-11)10(14)12-3-7-16-8-4-12/h1-8H2
InChIKey
DKRDJODCERTCFW-UHFFFAOYSA-N
Compound name
1,2-dimorpholin-4-ylethane-1,2-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

228.11101 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.118286 151.9
[M+Na]+ 251.100228 154.3
[M-H]- 227.103734 155.3
[M+NH4]+ 246.144833 163.3
[M+K]+ 267.074168 156.1
[M+H-H2O]+ 211.108270 143.0
[M+HCOO]- 273.109211 163.7
[M+CH3COO]- 287.124861 184.5
[M+Na-2H]- 249.085676 155.1
[M]+ 228.11046142 146.1
[M]- 228.11155858 146.1
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