CID 6329153

Dicyclohexylphosphine oxide

Structural Information

Molecular Formula

C₁₂H₂₂OP

SMILES

C1CCC(CC1)[P+](=O)C2CCCCC2

InChI

InChI=1S/C12H22OP/c13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h11-12H,1-10H2/q+1

InChIKey

HJPHBJYOODQSLK-UHFFFAOYSA-N

Compound name

dicyclohexyl(oxo)phosphanium

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 376
Patents: 213.14082 Da
Monoisotopic Mass: 2.6
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]+	214.14810	154.3
[M+Na]+	236.13004	154.8
[M-H]-	212.13354	157.7
[M+NH4]+	231.17464	172.0
[M+K]+	252.10398	147.6
[M+H-H2O]+	196.13808	147.7
[M+HCOO]-	258.13902	174.7
[M+CH3COO]-	272.15467	180.5
[M+Na-2H]-	234.11549	154.1
[M]+	213.14027	144.2
[M]-	213.14137	144.2

Literature stripe

literature stripe

Patent stripe

patents stripe