CID 110784

6122-51-6

Structural Information

Molecular Formula
C14H18N2O2
SMILES
C1CN(C(=O)C1N2CCOCC2)C3=CC=CC=C3
InChI
InChI=1S/C14H18N2O2/c17-14-13(15-8-10-18-11-9-15)6-7-16(14)12-4-2-1-3-5-12/h1-5,13H,6-11H2
InChIKey
YMKMWYLNDZDXBG-UHFFFAOYSA-N
Compound name
3-morpholin-4-yl-1-phenylpyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.13683 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.14411 156.6
[M+Na]+ 269.12605 161.5
[M-H]- 245.12955 163.2
[M+NH4]+ 264.17065 170.8
[M+K]+ 285.09999 159.2
[M+H-H2O]+ 229.13409 147.2
[M+HCOO]- 291.13503 173.0
[M+CH3COO]- 305.15068 167.3
[M+Na-2H]- 267.11150 158.3
[M]+ 246.13628 151.2
[M]- 246.13738 151.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.