CID 4533148

2-chloro-n-(3-chloro-4-methoxyphenyl)-2-phenylacetamide

Structural Information

Molecular Formula

C₁₅H₁₃Cl₂NO₂

SMILES

COC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)Cl)Cl

InChI

InChI=1S/C15H13Cl2NO2/c1-20-13-8-7-11(9-12(13)16)18-15(19)14(17)10-5-3-2-4-6-10/h2-9,14H,1H3,(H,18,19)

InChIKey

BKKDMADLNRAVGL-UHFFFAOYSA-N

Compound name

2-chloro-N-(3-chloro-4-methoxyphenyl)-2-phenylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 309.03235 Da
Monoisotopic Mass: 4.1
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]+	310.039626	166.0
[M+Na]+	332.021568	174.1
[M-H]-	308.025074	172.1
[M+NH4]+	327.066173	181.8
[M+K]+	347.995508	168.3
[M+H-H2O]+	292.029610	160.0
[M+HCOO]-	354.030551	180.2
[M+CH3COO]-	368.046201	204.5
[M+Na-2H]-	330.007016	168.9
[M]+	309.03180142	170.1
[M]-	309.03289858	170.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.