CID 3034328

21322-35-0

Structural Information

Molecular Formula
C33H29N5O4
SMILES
CN(CN1C(=O)C(NC1=O)(C2=CC=CC=C2)C3=CC=CC=C3)CN4C(=O)C(NC4=O)(C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C33H29N5O4/c1-36(22-37-28(39)32(34-30(37)41,24-14-6-2-7-15-24)25-16-8-3-9-17-25)23-38-29(40)33(35-31(38)42,26-18-10-4-11-19-26)27-20-12-5-13-21-27/h2-21H,22-23H2,1H3,(H,34,41)(H,35,42)
InChIKey
TUGXOPBOEKMSSZ-UHFFFAOYSA-N
Compound name
3-[[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl-methylamino]methyl]-5,5-diphenylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

559.222 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 560.22928 229.6
[M+Na]+ 582.21122 234.0
[M-H]- 558.21472 242.3
[M+NH4]+ 577.25582 232.8
[M+K]+ 598.18516 226.4
[M+H-H2O]+ 542.21926 215.1
[M+HCOO]- 604.22020 242.7
[M+CH3COO]- 618.23585 234.6
[M+Na-2H]- 580.19667 225.1
[M]+ 559.22145 225.4
[M]- 559.22255 225.4
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.