CID 351863

2-amino-4,6-dibromophenol

Structural Information

Molecular Formula

C₆H₅Br₂NO

SMILES

C1=C(C=C(C(=C1N)O)Br)Br

InChI

InChI=1S/C6H5Br2NO/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H,9H2

InChIKey

UFWSOGOVXJBJDP-UHFFFAOYSA-N

Compound name

2-amino-4,6-dibromophenol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 30
Patents: 264.87378 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]+	265.88106	143.5
[M+Na]+	287.86300	138.7
[M+NH4]+	282.90760	145.6
[M+K]+	303.83694	145.2
[M-H]-	263.86650	144.4
[M+Na-2H]-	285.84845	145.0
[M]+	264.87323	141.9
[M]-	264.87433	141.9

Literature stripe

literature stripe

Patent stripe

patents stripe