CID 91982

Ethyltrioctylphosphonium bromide

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

827
Patents

399.41196 Da
Monoisotopic Mass

10.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 400.41924 213.2
[M+Na]+ 422.40118 221.9
[M+NH4]+ 417.44578 189.3
[M+K]+ 438.37512 232.5
[M-H]- 398.40468 213.9
[M+Na-2H]- 420.38663 213.4
[M]+ 399.41141 214.9
[M]- 399.41251 214.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe