CID 3049263

2,4-dicyano-3-ethyl-3-methyl-n-(morpholinomethyl)glutarimide

Structural Information

Molecular Formula
C15H20N4O3
SMILES
CCC1(C(C(=O)N(C(=O)C1C#N)CN2CCOCC2)C#N)C
InChI
InChI=1S/C15H20N4O3/c1-3-15(2)11(8-16)13(20)19(14(21)12(15)9-17)10-18-4-6-22-7-5-18/h11-12H,3-7,10H2,1-2H3
InChIKey
BOXCQSCNUFVJIQ-UHFFFAOYSA-N
Compound name
4-ethyl-4-methyl-1-(morpholin-4-ylmethyl)-2,6-dioxopiperidine-3,5-dicarbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.15353 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.16081 161.9
[M+Na]+ 327.14275 170.7
[M-H]- 303.14625 164.6
[M+NH4]+ 322.18735 170.4
[M+K]+ 343.11669 166.5
[M+H-H2O]+ 287.15079 145.5
[M+HCOO]- 349.15173 167.7
[M+CH3COO]- 363.16738 229.5
[M+Na-2H]- 325.12820 161.9
[M]+ 304.15298 152.2
[M]- 304.15408 152.2
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.