CID 18705639

1204316-79-9

Structural Information

Molecular Formula

C₂₅H₅₄P

SMILES

CCCCCCCC[P+](C)(CCCCCCCC)CCCCCCCC

InChI

InChI=1S/C25H54P/c1-5-8-11-14-17-20-23-26(4,24-21-18-15-12-9-6-2)25-22-19-16-13-10-7-3/h5-25H2,1-4H3/q+1

InChIKey

AHCKRTXGDNIJSK-UHFFFAOYSA-N

Compound name

methyl(trioctyl)phosphanium

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 762
Patents: 385.3963 Da
Monoisotopic Mass: 10.2
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]+	386.40358	221.4
[M+Na]+	408.38552	221.2
[M-H]-	384.38902	203.0
[M+NH4]+	403.43012	216.6
[M+K]+	424.35946	210.7
[M+H-H2O]+	368.39356	214.6
[M+HCOO]-	430.39450	237.3
[M+CH3COO]-	444.41015	225.7
[M+Na-2H]-	406.37097	217.6
[M]+	385.39575	219.3
[M]-	385.39685	219.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe