CID 5274036

Akos008973223

Structural Information

Molecular Formula

C₁₄H₁₁Cl₂NO₂

SMILES

CC1=CC(=C(C=C1)C(=O)NC2=CC(=C(C=C2)Cl)Cl)O

InChI

InChI=1S/C14H11Cl2NO2/c1-8-2-4-10(13(18)6-8)14(19)17-9-3-5-11(15)12(16)7-9/h2-7,18H,1H3,(H,17,19)

InChIKey

FHPCNJFHCKLCRF-UHFFFAOYSA-N

Compound name

N-(3,4-dichlorophenyl)-2-hydroxy-4-methylbenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 295.0167 Da
Monoisotopic Mass: 5.0
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]+	296.023976	161.5
[M+Na]+	318.005918	171.8
[M-H]-	294.009424	167.1
[M+NH4]+	313.050523	177.9
[M+K]+	333.979858	165.1
[M+H-H2O]+	278.013960	156.5
[M+HCOO]-	340.014901	175.5
[M+CH3COO]-	354.030551	200.7
[M+Na-2H]-	315.991366	164.3
[M]+	295.01615142	164.8
[M]-	295.01724858	164.8

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.