CID 217788

39629-99-7

Structural Information

Molecular Formula

C₁₅H₁₈N₂O₃

SMILES

C1COCCN1C(=O)C2CC(=O)N(C2)C3=CC=CC=C3

InChI

InChI=1S/C15H18N2O3/c18-14-10-12(15(19)16-6-8-20-9-7-16)11-17(14)13-4-2-1-3-5-13/h1-5,12H,6-11H2

InChIKey

DBZMAKNIJBUOLD-UHFFFAOYSA-N

Compound name

4-(morpholine-4-carbonyl)-1-phenylpyrrolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 0
Patents: 274.13174 Da
Monoisotopic Mass: 0.1
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]+	275.139016	163.3
[M+Na]+	297.120958	167.6
[M-H]-	273.124464	169.9
[M+NH4]+	292.165563	176.2
[M+K]+	313.094898	165.7
[M+H-H2O]+	257.129000	153.9
[M+HCOO]-	319.129941	178.7
[M+CH3COO]-	333.145591	195.1
[M+Na-2H]-	295.106406	163.4
[M]+	274.13119142	158.3
[M]-	274.13228858	158.3

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.