CID 28917387

4-(3-aminophenyl)morpholin-3-one

Structural Information

Molecular Formula

C₁₀H₁₂N₂O₂

SMILES

C1COCC(=O)N1C2=CC=CC(=C2)N

InChI

InChI=1S/C10H12N2O2/c11-8-2-1-3-9(6-8)12-4-5-14-7-10(12)13/h1-3,6H,4-5,7,11H2

InChIKey

IABQKUMPNMOSKF-UHFFFAOYSA-N

Compound name

4-(3-aminophenyl)morpholin-3-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 192.08987 Da
Monoisotopic Mass: 0.3
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]+	193.09715	141.3
[M+Na]+	215.07909	153.7
[M+NH4]+	210.12369	149.4
[M+K]+	231.05303	148.0
[M-H]-	191.08259	146.3
[M+Na-2H]-	213.06454	148.1
[M]+	192.08932	144.3
[M]-	192.09042	144.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe