CID 11078910

221187-50-4

Structural Information

Molecular Formula

C₂₂H₃₃O₂P

SMILES

CC1(OCCO1)C2=CC=CC=C2P(C3CCCCC3)C4CCCCC4

InChI

InChI=1S/C22H33O2P/c1-22(23-16-17-24-22)20-14-8-9-15-21(20)25(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h8-9,14-15,18-19H,2-7,10-13,16-17H2,1H3

InChIKey

ZQASITYRQOCACA-UHFFFAOYSA-N

Compound name

dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 165
Patents: 360.22183 Da
Monoisotopic Mass: 4.7
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]+	361.22911	193.1
[M+Na]+	383.21105	191.5
[M-H]-	359.21455	202.5
[M+NH4]+	378.25565	205.3
[M+K]+	399.18499	190.1
[M+H-H2O]+	343.21909	181.6
[M+HCOO]-	405.22003	208.9
[M+CH3COO]-	419.23568	200.1
[M+Na-2H]-	381.19650	186.4
[M]+	360.22128	183.5
[M]-	360.22238	183.5

Literature stripe

literature stripe

Patent stripe

patents stripe