CID 3018531

2-(2-(2-methoxyethoxy)ethoxy)ethanamine

Structural Information

Molecular Formula

C₇H₁₇NO₃

SMILES

COCCOCCOCCN

InChI

InChI=1S/C7H17NO3/c1-9-4-5-11-7-6-10-3-2-8/h2-8H2,1H3

InChIKey

OKUWOEKJQRUMBW-UHFFFAOYSA-N

Compound name

2-[2-(2-methoxyethoxy)ethoxy]ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 784
Patents: 163.12085 Da
Monoisotopic Mass: -1.3
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]+	164.12813	136.1
[M+Na]+	186.11007	141.9
[M-H]-	162.11357	135.4
[M+NH4]+	181.15467	156.3
[M+K]+	202.08401	142.4
[M+H-H2O]+	146.11811	130.4
[M+HCOO]-	208.11905	160.6
[M+CH3COO]-	222.13470	180.3
[M+Na-2H]-	184.09552	141.8
[M]+	163.12030	140.3
[M]-	163.12140	140.3

Literature stripe

literature stripe

Patent stripe

patents stripe