CID 13548365

Ethanol, 2-[[2-(2-aminoethoxy)ethyl]amino]-

Structural Information

Molecular Formula

C₆H₁₆N₂O₂

SMILES

C(COCCNCCO)N

InChI

InChI=1S/C6H16N2O2/c7-1-5-10-6-3-8-2-4-9/h8-9H,1-7H2

InChIKey

MBWAKTVBXOPVNZ-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 97
Patents: 148.12119 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]+	149.128466	132.3
[M+Na]+	171.110408	137.3
[M-H]-	147.113914	130.4
[M+NH4]+	166.155013	152.0
[M+K]+	187.084348	136.5
[M+H-H2O]+	131.118450	126.7
[M+HCOO]-	193.119391	156.4
[M+CH3COO]-	207.135041	177.7
[M+Na-2H]-	169.095856	138.2
[M]+	148.12064142	131.9
[M]-	148.12173858	131.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe