CID 96184

Benzamide, n-(2,5-dichlorophenyl)-

Structural Information

Molecular Formula

C₁₃H₉Cl₂NO

SMILES

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

InChI

InChI=1S/C13H9Cl2NO/c14-10-6-7-11(15)12(8-10)16-13(17)9-4-2-1-3-5-9/h1-8H,(H,16,17)

InChIKey

FUNVESSXWQPDQU-UHFFFAOYSA-N

Compound name

N-(2,5-dichlorophenyl)benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 22
Patents: 265.00613 Da
Monoisotopic Mass: 4.4
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]+	266.013406	154.6
[M+Na]+	287.995348	164.0
[M-H]-	263.998854	160.8
[M+NH4]+	283.039953	172.2
[M+K]+	303.969288	157.5
[M+H-H2O]+	248.003390	149.0
[M+HCOO]-	310.004331	170.1
[M+CH3COO]-	324.019981	195.8
[M+Na-2H]-	285.980796	159.6
[M]+	265.00558142	157.1
[M]-	265.00667858	157.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe