CID 363325

3-(2-phenyl-1h-indol-3-yl)pyrrolidine-2,5-dione

Structural Information

Molecular Formula
C18H14N2O2
SMILES
C1C(C(=O)NC1=O)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4
InChI
InChI=1S/C18H14N2O2/c21-15-10-13(18(22)20-15)16-12-8-4-5-9-14(12)19-17(16)11-6-2-1-3-7-11/h1-9,13,19H,10H2,(H,20,21,22)
InChIKey
CCTHQRGUCMCKIK-UHFFFAOYSA-N
Compound name
3-(2-phenyl-1H-indol-3-yl)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.10553 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.112806 166.0
[M+Na]+ 313.094748 175.5
[M-H]- 289.098254 172.7
[M+NH4]+ 308.139353 181.9
[M+K]+ 329.068688 168.1
[M+H-H2O]+ 273.102790 158.0
[M+HCOO]- 335.103731 185.5
[M+CH3COO]- 349.119381 177.4
[M+Na-2H]- 311.080196 166.7
[M]+ 290.10498142 163.4
[M]- 290.10607858 163.4
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.