CID 284455

Phosphinic acid, bis(o-bromophenyl)-

Structural Information

Molecular Formula

C₁₂H₉Br₂O₂P

SMILES

C1=CC=C(C(=C1)P(=O)(C2=CC=CC=C2Br)O)Br

InChI

InChI=1S/C12H9Br2O2P/c13-9-5-1-3-7-11(9)17(15,16)12-8-4-2-6-10(12)14/h1-8H,(H,15,16)

InChIKey

MLQXYNWMVSKFPP-UHFFFAOYSA-N

Compound name

bis(2-bromophenyl)phosphinic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 373.8707 Da
Monoisotopic Mass: 3.4
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]+	374.87798	160.8
[M+Na]+	396.85992	156.5
[M+NH4]+	391.90452	162.5
[M+K]+	412.83386	162.6
[M-H]-	372.86342	162.1
[M+Na-2H]-	394.84537	163.2
[M]+	373.87015	159.5
[M]-	373.87125	159.5

Literature stripe

literature stripe

Patent stripe

patents stripe