CID 22542

6163-73-1

Structural Information

Molecular Formula

C₉H₂₁O₇P

SMILES

COCCOP(=O)(OCCOC)OCCOC

InChI

InChI=1S/C9H21O7P/c1-11-4-7-14-17(10,15-8-5-12-2)16-9-6-13-3/h4-9H2,1-3H3

InChIKey

QLNUSZCPEUTHBS-UHFFFAOYSA-N

Compound name

tris(2-methoxyethyl) phosphate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 195
Patents: 272.10248 Da
Monoisotopic Mass: -0.9
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]+	273.10976	160.7
[M+Na]+	295.09170	166.4
[M-H]-	271.09520	159.2
[M+NH4]+	290.13630	177.5
[M+K]+	311.06564	168.5
[M+H-H2O]+	255.09974	152.6
[M+HCOO]-	317.10068	188.9
[M+CH3COO]-	331.11633	196.9
[M+Na-2H]-	293.07715	164.3
[M]+	272.10193	173.8
[M]-	272.10303	173.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe