CID 18705966

13685-26-2

Structural Information

Molecular Formula

C₁₂H₈Cl₃P

SMILES

C1=CC(=CC=C1P(C2=CC=C(C=C2)Cl)Cl)Cl

InChI

InChI=1S/C12H8Cl3P/c13-9-1-5-11(6-2-9)16(15)12-7-3-10(14)4-8-12/h1-8H

InChIKey

UISLTICQIVPVGS-UHFFFAOYSA-N

Compound name

chloro-bis(4-chlorophenyl)phosphane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 38
Patents: 287.94293 Da
Monoisotopic Mass: 5.1
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]+	288.95021	154.7
[M+Na]+	310.93215	164.7
[M-H]-	286.93565	158.7
[M+NH4]+	305.97675	172.4
[M+K]+	326.90609	157.5
[M+H-H2O]+	270.94019	148.0
[M+HCOO]-	332.94113	168.5
[M+CH3COO]-	346.95678	199.6
[M+Na-2H]-	308.91760	155.2
[M]+	287.94238	158.3
[M]-	287.94348	158.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe