CID 365545

Nsc633246

Structural Information

Molecular Formula
C23H22N4O5
SMILES
C1CC(=O)N(C1=O)CNC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)NCN4C(=O)CCC4=O
InChI
InChI=1S/C23H22N4O5/c28-19-9-10-20(29)26(19)13-24-17-5-1-15(2-6-17)23(32)16-3-7-18(8-4-16)25-14-27-21(30)11-12-22(27)31/h1-8,24-25H,9-14H2
InChIKey
NZYORHOGNSGAKC-UHFFFAOYSA-N
Compound name
1-[[4-[4-[(2,5-dioxopyrrolidin-1-yl)methylamino]benzoyl]anilino]methyl]pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

434.15903 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 435.16631 199.3
[M+Na]+ 457.14825 203.5
[M-H]- 433.15175 209.9
[M+NH4]+ 452.19285 208.0
[M+K]+ 473.12219 198.7
[M+H-H2O]+ 417.15629 189.0
[M+HCOO]- 479.15723 219.2
[M+CH3COO]- 493.17288 233.0
[M+Na-2H]- 455.13370 194.9
[M]+ 434.15848 197.3
[M]- 434.15958 197.3
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.