CID 15606994

Diethylethoxyammonium chloride

Structural Information

Molecular Formula

SMILES

CCN(CC)OCC

InChI

InChI=1S/C6H15NO/c1-4-7(5-2)8-6-3/h4-6H2,1-3H3

InChIKey

BDGIOFKLQPUORK-UHFFFAOYSA-N

Compound name

N-ethoxy-N-ethylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 178
Patents: 117.115364 Da
Monoisotopic Mass: 1.4
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]+	118.12264	125.8
[M+Na]+	140.10458	132.4
[M-H]-	116.10809	127.6
[M+NH4]+	135.14919	149.0
[M+K]+	156.07852	134.1
[M+H-H2O]+	100.11262	120.8
[M+HCOO]-	162.11356	151.4
[M+CH3COO]-	176.12922	177.6
[M+Na-2H]-	138.09003	132.4
[M]+	117.11482	129.0
[M]-	117.11591	129.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.