CID 103568

51959-85-4

Structural Information

Molecular Formula

C₉H₁₄N₂O₃

SMILES

C1CC(=O)NC1C(=O)N2CCOCC2

InChI

InChI=1S/C9H14N2O3/c12-8-2-1-7(10-8)9(13)11-3-5-14-6-4-11/h7H,1-6H2,(H,10,12)

InChIKey

WPDJMBAXQKFEOI-UHFFFAOYSA-N

Compound name

5-(morpholine-4-carbonyl)pyrrolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 37
Patents: 198.10045 Da
Monoisotopic Mass: -1.2
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]+	199.107726	144.3
[M+Na]+	221.089668	148.5
[M-H]-	197.093174	146.4
[M+NH4]+	216.134273	159.8
[M+K]+	237.063608	147.8
[M+H-H2O]+	181.097710	136.7
[M+HCOO]-	243.098651	158.8
[M+CH3COO]-	257.114301	177.5
[M+Na-2H]-	219.075116	145.7
[M]+	198.09990142	137.5
[M]-	198.10099858	137.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe