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

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.13902 163.3
[M+Na]+ 297.12096 167.6
[M-H]- 273.12446 169.9
[M+NH4]+ 292.16556 176.2
[M+K]+ 313.09490 165.7
[M+H-H2O]+ 257.12900 153.9
[M+HCOO]- 319.12994 178.7
[M+CH3COO]- 333.14559 195.1
[M+Na-2H]- 295.10641 163.4
[M]+ 274.13119 158.3
[M]- 274.13229 158.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.