CID 352428

3,5-dibromosalicylamide

Structural Information

Molecular Formula

C₇H₅Br₂NO₂

SMILES

C1=C(C=C(C(=C1C(=O)N)O)Br)Br

InChI

InChI=1S/C7H5Br2NO2/c8-3-1-4(7(10)12)6(11)5(9)2-3/h1-2,11H,(H2,10,12)

InChIKey

UPLRPVGMEIBZLY-UHFFFAOYSA-N

Compound name

3,5-dibromo-2-hydroxybenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 292.8687 Da
Monoisotopic Mass: 2.4
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]+	293.87598	139.4
[M+Na]+	315.85792	150.1
[M-H]-	291.86142	144.9
[M+NH4]+	310.90252	157.5
[M+K]+	331.83186	133.9
[M+H-H2O]+	275.86596	146.3
[M+HCOO]-	337.86690	154.7
[M+CH3COO]-	351.88255	202.3
[M+Na-2H]-	313.84337	144.5
[M]+	292.86815	171.3
[M]-	292.86925	171.3

Literature stripe

literature stripe

Patent stripe

patents stripe