CID 310166

2,5'-dichloro-2',4'-dimethoxyacetanilide

Structural Information

Molecular Formula

C₁₀H₁₁Cl₂NO₃

SMILES

COC1=CC(=C(C=C1NC(=O)CCl)Cl)OC

InChI

InChI=1S/C10H11Cl2NO3/c1-15-8-4-9(16-2)7(3-6(8)12)13-10(14)5-11/h3-4H,5H2,1-2H3,(H,13,14)

InChIKey

ZNZPWAUYDVUDTN-UHFFFAOYSA-N

Compound name

2-chloro-N-(5-chloro-2,4-dimethoxyphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 263.0116 Da
Monoisotopic Mass: 2.3
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]+	264.018876	151.4
[M+Na]+	286.000818	161.4
[M-H]-	262.004324	155.1
[M+NH4]+	281.045423	169.8
[M+K]+	301.974758	157.3
[M+H-H2O]+	246.008860	147.3
[M+HCOO]-	308.009801	167.0
[M+CH3COO]-	322.025451	196.4
[M+Na-2H]-	283.986266	154.9
[M]+	263.01105142	158.1
[M]-	263.01214858	158.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.