CID 6167284

1-[4-(3-chlorophenyl)piperazino]-3-(4-methoxy-1-naphthyl)-2-propen-1-one

Structural Information

Molecular Formula
C24H23ClN2O2
SMILES
COC1=CC=C(C2=CC=CC=C21)/C=C/C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl
InChI
InChI=1S/C24H23ClN2O2/c1-29-23-11-9-18(21-7-2-3-8-22(21)23)10-12-24(28)27-15-13-26(14-16-27)20-6-4-5-19(25)17-20/h2-12,17H,13-16H2,1H3/b12-10+
InChIKey
SXMOHYLGOSZDAK-ZRDIBKRKSA-N
Compound name
(E)-1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(4-methoxynaphthalen-1-yl)prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

406.1448 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.15208 198.8
[M+Na]+ 429.13402 215.6
[M+NH4]+ 424.17862 206.9
[M+K]+ 445.10796 205.0
[M-H]- 405.13752 205.0
[M+Na-2H]- 427.11947 207.5
[M]+ 406.14425 203.4
[M]- 406.14535 203.4
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.