CID 722377

3-chloro-2'-methoxybenzanilide

Structural Information

Molecular Formula

C₁₄H₁₂ClNO₂

SMILES

COC1=CC=CC=C1NC(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C14H12ClNO2/c1-18-13-8-3-2-7-12(13)16-14(17)10-5-4-6-11(15)9-10/h2-9H,1H3,(H,16,17)

InChIKey

WSBUHLCNENMCJP-UHFFFAOYSA-N

Compound name

3-chloro-N-(2-methoxyphenyl)benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 1
Patents: 261.05566 Da
Monoisotopic Mass: 3.4
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]+	262.06294	156.0
[M+Na]+	284.04488	164.5
[M-H]-	260.04838	163.0
[M+NH4]+	279.08948	173.3
[M+K]+	300.01882	159.7
[M+H-H2O]+	244.05292	149.3
[M+HCOO]-	306.05386	176.6
[M+CH3COO]-	320.06951	196.3
[M+Na-2H]-	282.03033	161.3
[M]+	261.05511	158.9
[M]-	261.05621	158.9

Literature stripe

literature stripe

Patent stripe

patents stripe