CID 4368797

136802-85-2

Structural Information

Molecular Formula

C₁₈H₂₂ClO₂P

SMILES

CC1=CC(=CC(=C1OC)C)P(C2=CC(=C(C(=C2)C)OC)C)Cl

InChI

InChI=1S/C18H22ClO2P/c1-11-7-15(8-12(2)17(11)20-5)22(19)16-9-13(3)18(21-6)14(4)10-16/h7-10H,1-6H3

InChIKey

JWCZKGYRAINWJA-UHFFFAOYSA-N

Compound name

chloro-bis(4-methoxy-3,5-dimethylphenyl)phosphane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 122
Patents: 336.10458 Da
Monoisotopic Mass: 5.2
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]+	337.11186	177.9
[M+Na]+	359.09380	194.0
[M+NH4]+	354.13840	186.4
[M+K]+	375.06774	185.5
[M-H]-	335.09730	182.7
[M+Na-2H]-	357.07925	185.2
[M]+	336.10403	182.1
[M]-	336.10513	182.1

Literature stripe

literature stripe

Patent stripe

patents stripe