CID 381771

Nsc668843

Structural Information

Molecular Formula
C24H16N2O2
SMILES
C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C4=CC(=O)N(C4=O)C5=CC=CC=C5
InChI
InChI=1S/C24H16N2O2/c27-21-15-19(24(28)26(21)17-11-5-2-6-12-17)22-18-13-7-8-14-20(18)25-23(22)16-9-3-1-4-10-16/h1-15,25H
InChIKey
DGGPBBHDUMVWOZ-UHFFFAOYSA-N
Compound name
1-phenyl-3-(2-phenyl-1H-indol-3-yl)pyrrole-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.1212 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.12848 186.7
[M+Na]+ 387.11042 196.8
[M-H]- 363.11392 198.1
[M+NH4]+ 382.15502 199.8
[M+K]+ 403.08436 188.4
[M+H-H2O]+ 347.11846 176.8
[M+HCOO]- 409.11940 207.9
[M+CH3COO]- 423.13505 197.7
[M+Na-2H]- 385.09587 186.6
[M]+ 364.12065 186.9
[M]- 364.12175 186.9
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.