CID 518897

14180-51-9

Structural Information

Molecular Formula

C₂₀H₁₉O₂P

SMILES

COC1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H19O2P/c1-21-16-8-12-19(13-9-16)23(18-6-4-3-5-7-18)20-14-10-17(22-2)11-15-20/h3-15H,1-2H3

InChIKey

BJPHLVZNHDIUNY-UHFFFAOYSA-N

Compound name

bis(4-methoxyphenyl)-phenylphosphane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 300
Patents: 322.11227 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]+	323.11955	178.6
[M+Na]+	345.10149	184.4
[M-H]-	321.10499	186.7
[M+NH4]+	340.14609	192.5
[M+K]+	361.07543	180.2
[M+H-H2O]+	305.10953	166.7
[M+HCOO]-	367.11047	206.3
[M+CH3COO]-	381.12612	210.0
[M+Na-2H]-	343.08694	178.5
[M]+	322.11172	180.6
[M]-	322.11282	180.6

Literature stripe

literature stripe

Patent stripe

patents stripe