CID 6327349

Dibutyl phosphite

Structural Information

Molecular Formula

C₈H₁₈O₃P

SMILES

CCCCO[P+](=O)OCCCC

InChI

InChI=1S/C8H18O3P/c1-3-5-7-10-12(9)11-8-6-4-2/h3-8H2,1-2H3/q+1

InChIKey

OSPSWZSRKYCQPF-UHFFFAOYSA-N

Compound name

dibutoxy(oxo)phosphanium

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 1
References: 9528
Patents: 193.09935 Da
Monoisotopic Mass: 2.5
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]+	194.10663	147.4
[M+Na]+	216.08857	153.6
[M-H]-	192.09207	146.5
[M+NH4]+	211.13317	167.4
[M+K]+	232.06251	148.5
[M+H-H2O]+	176.09661	142.9
[M+HCOO]-	238.09755	175.4
[M+CH3COO]-	252.11320	179.3
[M+Na-2H]-	214.07402	151.1
[M]+	193.09880	152.9
[M]-	193.09990	152.9

Literature stripe

literature stripe

Patent stripe

patents stripe