CID 91982

56022-37-8

Structural Information

Molecular Formula

C₂₆H₅₆P

SMILES

CCCCCCCC[P+](CC)(CCCCCCCC)CCCCCCCC

InChI

InChI=1S/C26H56P/c1-5-9-12-15-18-21-24-27(8-4,25-22-19-16-13-10-6-2)26-23-20-17-14-11-7-3/h5-26H2,1-4H3/q+1

InChIKey

HRTLENMHZSETQO-UHFFFAOYSA-N

Compound name

ethyl(trioctyl)phosphanium

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 867
Patents: 399.41196 Da
Monoisotopic Mass: 10.6
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]+	400.41924	226.0
[M+Na]+	422.40118	228.1
[M-H]-	398.40468	206.3
[M+NH4]+	417.44578	220.3
[M+K]+	438.37512	214.6
[M+H-H2O]+	382.40922	219.0
[M+HCOO]-	444.41016	240.6
[M+CH3COO]-	458.42581	228.7
[M+Na-2H]-	420.38663	221.7
[M]+	399.41141	222.8
[M]-	399.41251	222.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe