CID 90263

23783-42-8

Structural Information

Molecular Formula

C₉H₂₀O₅

SMILES

COCCOCCOCCOCCO

InChI

InChI=1S/C9H20O5/c1-11-4-5-13-8-9-14-7-6-12-3-2-10/h10H,2-9H2,1H3

InChIKey

ZNYRFEPBTVGZDN-UHFFFAOYSA-N

Compound name

2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanol

Related CIDs

2D Structure

compound 2d structure

5
Annotation Hits: 2
References: 7666
Patents: 208.13107 Da
Monoisotopic Mass: -1.0
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]+	209.138346	146.8
[M+Na]+	231.120288	152.1
[M-H]-	207.123794	144.9
[M+NH4]+	226.164893	165.0
[M+K]+	247.094228	152.6
[M+H-H2O]+	191.128330	141.0
[M+HCOO]-	253.129271	169.3
[M+CH3COO]-	267.144921	183.5
[M+Na-2H]-	229.105736	151.9
[M]+	208.13052142	154.6
[M]-	208.13161858	154.6

Literature stripe

literature stripe

Patent stripe

patents stripe