CID 3058106

74619-89-9

Structural Information

Molecular Formula
C15H24N2O3
SMILES
CCC1(C(=O)C=CN(C1=O)CCN2CCOCC2)CC
InChI
InChI=1S/C15H24N2O3/c1-3-15(4-2)13(18)5-6-17(14(15)19)8-7-16-9-11-20-12-10-16/h5-6H,3-4,7-12H2,1-2H3
InChIKey
RUMVLVRGZSNKGA-UHFFFAOYSA-N
Compound name
3,3-diethyl-1-(2-morpholin-4-ylethyl)pyridine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.17868 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.185956 167.2
[M+Na]+ 303.167898 172.4
[M-H]- 279.171404 170.6
[M+NH4]+ 298.212503 180.9
[M+K]+ 319.141838 170.9
[M+H-H2O]+ 263.175940 158.5
[M+HCOO]- 325.176881 181.4
[M+CH3COO]- 339.192531 199.8
[M+Na-2H]- 301.153346 169.5
[M]+ 280.17813142 165.5
[M]- 280.17922858 165.5
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

No patent data available for this compound.