CID 28583171

Methyl 2-{[2-(morpholin-4-yl)ethyl]amino}acetate

Structural Information

Molecular Formula

C₉H₁₈N₂O₃

SMILES

COC(=O)CNCCN1CCOCC1

InChI

InChI=1S/C9H18N2O3/c1-13-9(12)8-10-2-3-11-4-6-14-7-5-11/h10H,2-8H2,1H3

InChIKey

LCXAUDAVNQNHPV-UHFFFAOYSA-N

Compound name

methyl 2-(2-morpholin-4-ylethylamino)acetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 15
Patents: 202.13174 Da
Monoisotopic Mass: -0.6
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]+	203.139016	146.6
[M+Na]+	225.120958	150.0
[M-H]-	201.124464	148.1
[M+NH4]+	220.165563	162.2
[M+K]+	241.094898	150.9
[M+H-H2O]+	185.129000	139.0
[M+HCOO]-	247.129941	165.4
[M+CH3COO]-	261.145591	185.3
[M+Na-2H]-	223.106406	151.8
[M]+	202.13119142	145.4
[M]-	202.13228858	145.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe