CID 3046554

Brn 1490626

Structural Information

Molecular Formula
C23H17NO2
SMILES
C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C(=O)CC(=O)C4=CC=CC=C4
InChI
InChI=1S/C23H17NO2/c25-20(16-9-3-1-4-10-16)15-21(26)22-18-13-7-8-14-19(18)24-23(22)17-11-5-2-6-12-17/h1-14,24H,15H2
InChIKey
LRUOVEAYKPZGPV-UHFFFAOYSA-N
Compound name
1-phenyl-3-(2-phenyl-1H-indol-3-yl)propane-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.12592 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.13320 181.4
[M+Na]+ 362.11514 197.6
[M+NH4]+ 357.15974 189.6
[M+K]+ 378.08908 190.3
[M-H]- 338.11864 187.4
[M+Na-2H]- 360.10059 191.9
[M]+ 339.12537 185.6
[M]- 339.12647 185.6
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.