CID 71165

Morsuximide

Structural Information

Molecular Formula
C16H20N2O3
SMILES
CC1(CC(=O)N(C1=O)CN2CCOCC2)C3=CC=CC=C3
InChI
InChI=1S/C16H20N2O3/c1-16(13-5-3-2-4-6-13)11-14(19)18(15(16)20)12-17-7-9-21-10-8-17/h2-6H,7-12H2,1H3
InChIKey
WCHQWOQHNBKKDS-UHFFFAOYSA-N
Compound name
3-methyl-1-(morpholin-4-ylmethyl)-3-phenylpyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

61
Patents

288.1474 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.15468 166.8
[M+Na]+ 311.13662 172.8
[M-H]- 287.14012 173.8
[M+NH4]+ 306.18122 181.5
[M+K]+ 327.11056 170.5
[M+H-H2O]+ 271.14466 157.7
[M+HCOO]- 333.14560 182.9
[M+CH3COO]- 347.16125 198.6
[M+Na-2H]- 309.12207 168.0
[M]+ 288.14685 163.5
[M]- 288.14795 163.5
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