CID 11595705

N-[2-(2-benzoyl-4-chloro-phenyl)ethyl]benzamide

Structural Information

Molecular Formula
C22H18ClNO2
SMILES
C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)CCNC(=O)C3=CC=CC=C3
InChI
InChI=1S/C22H18ClNO2/c23-19-12-11-16(13-14-24-22(26)18-9-5-2-6-10-18)20(15-19)21(25)17-7-3-1-4-8-17/h1-12,15H,13-14H2,(H,24,26)
InChIKey
YLBNAKSDBVGBGG-UHFFFAOYSA-N
Compound name
N-[2-(2-benzoyl-4-chlorophenyl)ethyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

363.1026 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.10988 186.3
[M+Na]+ 386.09182 192.3
[M-H]- 362.09532 195.3
[M+NH4]+ 381.13642 198.4
[M+K]+ 402.06576 185.3
[M+H-H2O]+ 346.09986 177.2
[M+HCOO]- 408.10080 204.4
[M+CH3COO]- 422.11645 216.2
[M+Na-2H]- 384.07727 188.5
[M]+ 363.10205 188.1
[M]- 363.10315 188.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.