CID 6327514

Bis(2-ethylhexyl) phosphite

Structural Information

Molecular Formula

C₁₆H₃₄O₃P

SMILES

CCCCC(CC)CO[P+](=O)OCC(CC)CCCC

InChI

InChI=1S/C16H34O3P/c1-5-9-11-15(7-3)13-18-20(17)19-14-16(8-4)12-10-6-2/h15-16H,5-14H2,1-4H3/q+1

InChIKey

ZLMKQJQJURXYLC-UHFFFAOYSA-N

Compound name

bis(2-ethylhexoxy)-oxophosphanium

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 4
References: 3626
Patents: 305.22455 Da
Monoisotopic Mass: 6.2
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]+	306.231826	186.7
[M+Na]+	328.213768	189.1
[M-H]-	304.217274	184.5
[M+NH4]+	323.258373	191.6
[M+K]+	344.187708	182.8
[M+H-H2O]+	288.221810	180.8
[M+HCOO]-	350.222751	202.6
[M+CH3COO]-	364.238401	204.7
[M+Na-2H]-	326.199216	183.5
[M]+	305.22400142	193.8
[M]-	305.22509858	193.8

Literature stripe

literature stripe

Patent stripe

patents stripe