CID 78179

4439-20-7

Structural Information

Molecular Formula

C₆H₁₆N₂O₂

SMILES

C(CNCCO)NCCO

InChI

InChI=1S/C6H16N2O2/c9-5-3-7-1-2-8-4-6-10/h7-10H,1-6H2

InChIKey

GFIWSSUBVYLTRF-UHFFFAOYSA-N

Compound name

2-[2-(2-hydroxyethylamino)ethylamino]ethanol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 6
References: 4209
Patents: 148.12119 Da
Monoisotopic Mass: -1.9
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]+	149.12847	132.0
[M+Na]+	171.11041	138.8
[M+NH4]+	166.15501	138.4
[M+K]+	187.08435	134.4
[M-H]-	147.11391	130.9
[M+Na-2H]-	169.09586	134.3
[M]+	148.12064	132.0
[M]-	148.12174	132.0

Literature stripe

literature stripe

Patent stripe

patents stripe