CID 139596875

Ns00095443

Structural Information

Molecular Formula

C₂₀H₄₃NO₁₀

SMILES

C(COCCOCCOCCO)NCCOCCOCCOCCOCCOCCO

InChI

InChI=1S/C20H43NO10/c22-3-7-26-11-15-28-13-9-24-5-1-21-2-6-25-10-14-29-17-19-31-20-18-30-16-12-27-8-4-23/h21-23H,1-20H2

InChIKey

QZUKKOPFCRPHOO-UHFFFAOYSA-N

Compound name

2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethoxy]ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 457.2887 Da
Monoisotopic Mass: -2.8
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]+	458.295976	227.9
[M+Na]+	480.277918	229.6
[M-H]-	456.281424	218.5
[M+NH4]+	475.322523	225.2
[M+K]+	496.251858	222.5
[M+H-H2O]+	440.285960	226.3
[M+HCOO]-	502.286901	237.3
[M+CH3COO]-	516.302551	228.6
[M+Na-2H]-	478.263366	211.8
[M]+	457.28815142	224.8
[M]-	457.28924858	224.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.