CID 243556

3,5-dibromobiphenyl-4-ol

Structural Information

Molecular Formula

C₁₂H₈Br₂O

SMILES

C1=CC=C(C=C1)C2=CC(=C(C(=C2)Br)O)Br

InChI

InChI=1S/C12H8Br2O/c13-10-6-9(7-11(14)12(10)15)8-4-2-1-3-5-8/h1-7,15H

InChIKey

SKQRVOXIIAXXEM-UHFFFAOYSA-N

Compound name

2,6-dibromo-4-phenylphenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 10
Patents: 325.8942 Da
Monoisotopic Mass: 4.6
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]+	326.90148	152.9
[M+Na]+	348.88342	149.8
[M+NH4]+	343.92802	155.6
[M+K]+	364.85736	155.1
[M-H]-	324.88692	155.3
[M+Na-2H]-	346.86887	156.3
[M]+	325.89365	152.2
[M]-	325.89475	152.2

Literature stripe

literature stripe

Patent stripe

patents stripe