CID 6068

Fenimide

Structural Information

Molecular Formula
C13H15NO2
SMILES
CCC1C(=O)NC(=O)C1(C)C2=CC=CC=C2
InChI
InChI=1S/C13H15NO2/c1-3-10-11(15)14-12(16)13(10,2)9-7-5-4-6-8-9/h4-8,10H,3H2,1-2H3,(H,14,15,16)
InChIKey
WYOMHOATUARGQV-UHFFFAOYSA-N
Compound name
4-ethyl-3-methyl-3-phenylpyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

531
Patents

217.11028 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.117556 147.2
[M+Na]+ 240.099498 156.1
[M-H]- 216.103004 151.8
[M+NH4]+ 235.144103 167.8
[M+K]+ 256.073438 152.1
[M+H-H2O]+ 200.107540 141.3
[M+HCOO]- 262.108481 168.0
[M+CH3COO]- 276.124131 185.0
[M+Na-2H]- 238.084946 150.1
[M]+ 217.10973142 145.5
[M]- 217.11082858 145.5
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