CID 515963

Chembl434661

Structural Information

Molecular Formula
C22H16N2O3
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)CN3C4=C(C=C(C=C4)C(=O)N)C(=O)C3=O
InChI
InChI=1S/C22H16N2O3/c23-21(26)17-10-11-19-18(12-17)20(25)22(27)24(19)13-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-12H,13H2,(H2,23,26)
InChIKey
HPWXTXFKWYWTON-UHFFFAOYSA-N
Compound name
2,3-dioxo-1-[(4-phenylphenyl)methyl]indole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

356.1161 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.12338 184.3
[M+Na]+ 379.10532 192.6
[M-H]- 355.10882 193.9
[M+NH4]+ 374.14992 197.5
[M+K]+ 395.07926 186.3
[M+H-H2O]+ 339.11336 174.8
[M+HCOO]- 401.11430 205.4
[M+CH3COO]- 415.12995 195.0
[M+Na-2H]- 377.09077 184.6
[M]+ 356.11555 183.9
[M]- 356.11665 183.9
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.