CID 2383

Bis(2-methoxyethyl)amine

Structural Information

Molecular Formula

C₆H₁₅NO₂

SMILES

COCCNCCOC

InChI

InChI=1S/C6H15NO2/c1-8-5-3-7-4-6-9-2/h7H,3-6H2,1-2H3

InChIKey

IBZKBSXREAQDTO-UHFFFAOYSA-N

Compound name

2-methoxy-N-(2-methoxyethyl)ethanamine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 2
References: 6819
Patents: 133.11028 Da
Monoisotopic Mass: -0.5
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]+	134.117556	128.6
[M+Na]+	156.099498	134.9
[M-H]-	132.103004	128.8
[M+NH4]+	151.144103	150.4
[M+K]+	172.073438	135.6
[M+H-H2O]+	116.107540	123.5
[M+HCOO]-	178.108481	153.9
[M+CH3COO]-	192.124131	176.0
[M+Na-2H]-	154.084946	135.9
[M]+	133.10973142	132.0
[M]-	133.11082858	132.0

Literature stripe

literature stripe

Patent stripe

patents stripe