CID 7168

Benzanilide

Structural Information

Molecular Formula

C₁₃H₁₁NO

SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C13H11NO/c15-13(11-7-3-1-4-8-11)14-12-9-5-2-6-10-12/h1-10H,(H,14,15)

InChIKey

ZVSKZLHKADLHSD-UHFFFAOYSA-N

Compound name

N-phenylbenzamide

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 111
References: 13429
Patents: 197.08406 Da
Monoisotopic Mass: 2.6
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]+	198.09134	141.8
[M+Na]+	220.07328	148.1
[M-H]-	196.07678	148.4
[M+NH4]+	215.11788	160.2
[M+K]+	236.04722	144.7
[M+H-H2O]+	180.08132	134.5
[M+HCOO]-	242.08226	167.0
[M+CH3COO]-	256.09791	185.3
[M+Na-2H]-	218.05873	149.6
[M]+	197.08351	139.8
[M]-	197.08461	139.8

Literature stripe

literature stripe

Patent stripe

patents stripe