CID 218726

N-(2-benzoylphenyl)-3-chlorobenzamide

Structural Information

Molecular Formula

C₂₀H₁₄ClNO₂

SMILES

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H14ClNO2/c21-16-10-6-9-15(13-16)20(24)22-18-12-5-4-11-17(18)19(23)14-7-2-1-3-8-14/h1-13H,(H,22,24)

InChIKey

VFMZOWHFOARGLN-UHFFFAOYSA-N

Compound name

N-(2-benzoylphenyl)-3-chlorobenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 335.07132 Da
Monoisotopic Mass: 5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	336.078596	177.1
[M+Na]+	358.060538	184.1
[M-H]-	334.064044	186.5
[M+NH4]+	353.105143	190.5
[M+K]+	374.034478	177.5
[M+H-H2O]+	318.068580	168.5
[M+HCOO]-	380.069521	196.0
[M+CH3COO]-	394.085171	210.4
[M+Na-2H]-	356.045986	180.4
[M]+	335.07077142	178.3
[M]-	335.07186858	178.3

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.