CID 73910

Diphenylphosphinic chloride

Structural Information

Molecular Formula

C₁₂H₁₀ClOP

SMILES

C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)Cl

InChI

InChI=1S/C12H10ClOP/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H

InChIKey

QPQGTZMAQRXCJW-UHFFFAOYSA-N

Compound name

[chloro(phenyl)phosphoryl]benzene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 5122
Patents: 236.01578 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]+	237.02306	149.8
[M+Na]+	259.00500	158.4
[M-H]-	235.00850	155.4
[M+NH4]+	254.04960	168.6
[M+K]+	274.97894	153.2
[M+H-H2O]+	219.01304	141.5
[M+HCOO]-	281.01398	174.1
[M+CH3COO]-	295.02963	188.4
[M+Na-2H]-	256.99045	154.9
[M]+	236.01523	151.8
[M]-	236.01633	151.8

Literature stripe

literature stripe

Patent stripe

patents stripe