CID 3490010

477328-87-3

Structural Information

Molecular Formula
C24H26N2O2
SMILES
COC1=CC=C(C=C1)N2CCN(CC2)CCC(=O)C3=CC4=CC=CC=C4C=C3
InChI
InChI=1S/C24H26N2O2/c1-28-23-10-8-22(9-11-23)26-16-14-25(15-17-26)13-12-24(27)21-7-6-19-4-2-3-5-20(19)18-21/h2-11,18H,12-17H2,1H3
InChIKey
NGIYYMMYYSHHCL-UHFFFAOYSA-N
Compound name
3-[4-(4-methoxyphenyl)piperazin-1-yl]-1-naphthalen-2-ylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

374.19943 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.20671 193.7
[M+Na]+ 397.18865 209.1
[M+NH4]+ 392.23325 201.7
[M+K]+ 413.16259 199.4
[M-H]- 373.19215 200.0
[M+Na-2H]- 395.17410 202.6
[M]+ 374.19888 197.8
[M]- 374.19998 197.8
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.