CID 3053147

1'-(1-naphthalenyl)-(1,3'-bipyrrolidine)-2,2',5,5'-tetrone

Structural Information

Molecular Formula
C18H14N2O4
SMILES
C1CC(=O)N(C1=O)C2CC(=O)N(C2=O)C3=CC=CC4=CC=CC=C43
InChI
InChI=1S/C18H14N2O4/c21-15-8-9-16(22)19(15)14-10-17(23)20(18(14)24)13-7-3-5-11-4-1-2-6-12(11)13/h1-7,14H,8-10H2
InChIKey
MIWLWDJIPXEKRO-UHFFFAOYSA-N
Compound name
3-(2,5-dioxopyrrolidin-1-yl)-1-naphthalen-1-ylpyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.09537 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.10265 174.6
[M+Na]+ 345.08459 186.8
[M+NH4]+ 340.12919 181.1
[M+K]+ 361.05853 184.4
[M-H]- 321.08809 177.7
[M+Na-2H]- 343.07004 179.0
[M]+ 322.09482 176.9
[M]- 322.09592 176.9
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.