CID 222876

2,4-dichloro-n-hydroxybenzamide

Structural Information

Molecular Formula

C₇H₅Cl₂NO₂

SMILES

C1=CC(=C(C=C1Cl)Cl)C(=O)NO

InChI

InChI=1S/C7H5Cl2NO2/c8-4-1-2-5(6(9)3-4)7(11)10-12/h1-3,12H,(H,10,11)

InChIKey

ZHHUWPHSXFCRIP-UHFFFAOYSA-N

Compound name

2,4-dichloro-N-hydroxybenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 10
Patents: 204.96973 Da
Monoisotopic Mass: 2.1
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]+	205.97701	135.8
[M+Na]+	227.95895	145.8
[M-H]-	203.96245	138.2
[M+NH4]+	223.00355	155.5
[M+K]+	243.93289	140.9
[M+H-H2O]+	187.96699	132.6
[M+HCOO]-	249.96793	150.6
[M+CH3COO]-	263.98358	181.8
[M+Na-2H]-	225.94440	141.0
[M]+	204.96918	137.7
[M]-	204.97028	137.7

Literature stripe

literature stripe

Patent stripe

patents stripe