CID 61848139

2-{[2-(2-methoxyethoxy)ethyl]amino}ethan-1-ol

Structural Information

Molecular Formula

C₇H₁₇NO₃

SMILES

COCCOCCNCCO

InChI

InChI=1S/C7H17NO3/c1-10-6-7-11-5-3-8-2-4-9/h8-9H,2-7H2,1H3

InChIKey

WQCCNFUBGKJNCU-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 163.12085 Da
Monoisotopic Mass: -1.2
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]+	164.128126	136.2
[M+Na]+	186.110068	141.6
[M-H]-	162.113574	134.7
[M+NH4]+	181.154673	156.0
[M+K]+	202.084008	141.5
[M+H-H2O]+	146.118110	130.8
[M+HCOO]-	208.119051	159.9
[M+CH3COO]-	222.134701	178.3
[M+Na-2H]-	184.095516	142.5
[M]+	163.12030142	139.5
[M]-	163.12139858	139.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe