CID 306565

N-(2-benzoyl-4-chlorophenyl)-4-nitrobenzamide

Structural Information

Molecular Formula
C20H13ClN2O4
SMILES
C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]
InChI
InChI=1S/C20H13ClN2O4/c21-15-8-11-18(17(12-15)19(24)13-4-2-1-3-5-13)22-20(25)14-6-9-16(10-7-14)23(26)27/h1-12H,(H,22,25)
InChIKey
KIEGXLJFCOKEHD-UHFFFAOYSA-N
Compound name
N-(2-benzoyl-4-chlorophenyl)-4-nitrobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

380.0564 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.06368 185.3
[M+Na]+ 403.04562 201.3
[M+NH4]+ 398.09022 192.6
[M+K]+ 419.01956 195.7
[M-H]- 379.04912 193.0
[M+Na-2H]- 401.03107 195.5
[M]+ 380.05585 190.0
[M]- 380.05695 190.0
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.