CID 24212664

N-(2,6-dichlorophenyl)-2-(2,5-dimethylphenoxy)acetamide

Structural Information

Molecular Formula

C₁₆H₁₅Cl₂NO₂

SMILES

CC1=CC(=C(C=C1)C)OCC(=O)NC2=C(C=CC=C2Cl)Cl

InChI

InChI=1S/C16H15Cl2NO2/c1-10-6-7-11(2)14(8-10)21-9-15(20)19-16-12(17)4-3-5-13(16)18/h3-8H,9H2,1-2H3,(H,19,20)

InChIKey

JFXQYOGZYUSYEE-UHFFFAOYSA-N

Compound name

N-(2,6-dichlorophenyl)-2-(2,5-dimethylphenoxy)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 323.04797 Da
Monoisotopic Mass: 4.8
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]+	324.055246	170.8
[M+Na]+	346.037188	180.5
[M-H]-	322.040694	177.3
[M+NH4]+	341.081793	186.6
[M+K]+	362.011128	174.2
[M+H-H2O]+	306.045230	164.9
[M+HCOO]-	368.046171	185.5
[M+CH3COO]-	382.061821	208.9
[M+Na-2H]-	344.022636	172.8
[M]+	323.04742142	176.5
[M]-	323.04851858	176.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.