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]+ 281.18596 167.2
[M+Na]+ 303.16790 172.4
[M-H]- 279.17140 170.6
[M+NH4]+ 298.21250 180.9
[M+K]+ 319.14184 170.9
[M+H-H2O]+ 263.17594 158.5
[M+HCOO]- 325.17688 181.4
[M+CH3COO]- 339.19253 199.8
[M+Na-2H]- 301.15335 169.5
[M]+ 280.17813 165.5
[M]- 280.17923 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.