CID 11679939

Ethyl 2-(cyclohexylamino)acetate hydrochloride

Structural Information

Molecular Formula

C₁₀H₁₉NO₂

SMILES

CCOC(=O)CNC1CCCCC1

InChI

InChI=1S/C10H19NO2/c1-2-13-10(12)8-11-9-6-4-3-5-7-9/h9,11H,2-8H2,1H3

InChIKey

NHRFJPKXIYYFMX-UHFFFAOYSA-N

Compound name

ethyl 2-(cyclohexylamino)acetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 116
Patents: 185.14159 Da
Monoisotopic Mass: 2.1
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]+	186.14887	143.8
[M+Na]+	208.13081	152.3
[M+NH4]+	203.17541	151.6
[M+K]+	224.10475	146.6
[M-H]-	184.13431	145.3
[M+Na-2H]-	206.11626	147.8
[M]+	185.14104	145.0
[M]-	185.14214	145.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe