CID 21737076

34188-11-9

Structural Information

Molecular Formula

C₁₀H₂₃NO₅

SMILES

C(COCCOCCOCCOCCO)N

InChI

InChI=1S/C10H23NO5/c11-1-3-13-5-7-15-9-10-16-8-6-14-4-2-12/h12H,1-11H2

InChIKey

DEOUHEFHTMMUCM-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 161
Patents: 237.15762 Da
Monoisotopic Mass: -2.0
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]+	238.16490	154.1
[M+Na]+	260.14684	157.9
[M-H]-	236.15034	151.3
[M+NH4]+	255.19144	170.4
[M+K]+	276.12078	157.8
[M+H-H2O]+	220.15488	147.4
[M+HCOO]-	282.15582	176.6
[M+CH3COO]-	296.17147	190.9
[M+Na-2H]-	258.13229	157.9
[M]+	237.15707	160.4
[M]-	237.15817	160.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe