CID 3071833

139084-80-3

Structural Information

Molecular Formula
C15H19ClN2O2
SMILES
CN1CCN(CC1)C2CC(OC2=O)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C15H19ClN2O2/c1-17-6-8-18(9-7-17)13-10-14(20-15(13)19)11-2-4-12(16)5-3-11/h2-5,13-14H,6-10H2,1H3
InChIKey
WJZWNVZDXIOCLT-UHFFFAOYSA-N
Compound name
5-(4-chlorophenyl)-3-(4-methylpiperazin-1-yl)oxolan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.1135 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.12078 167.4
[M+Na]+ 317.10272 180.8
[M+NH4]+ 312.14732 175.6
[M+K]+ 333.07666 175.4
[M-H]- 293.10622 173.0
[M+Na-2H]- 315.08817 173.3
[M]+ 294.11295 171.1
[M]- 294.11405 171.1
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.