CID 1164543

1-(o-methoxyphenyl)-4-(3,4,5-trimethoxycinnamoyl)-piperazine

Structural Information

Molecular Formula
C23H28N2O5
SMILES
COC1=CC=CC=C1N2CCN(CC2)C(=O)/C=C/C3=CC(=C(C(=C3)OC)OC)OC
InChI
InChI=1S/C23H28N2O5/c1-27-19-8-6-5-7-18(19)24-11-13-25(14-12-24)22(26)10-9-17-15-20(28-2)23(30-4)21(16-17)29-3/h5-10,15-16H,11-14H2,1-4H3/b10-9+
InChIKey
PWRCUHCOVBDREG-MDZDMXLPSA-N
Compound name
(E)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

412.19983 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 413.20711 200.9
[M+Na]+ 435.18905 205.8
[M-H]- 411.19255 207.0
[M+NH4]+ 430.23365 208.1
[M+K]+ 451.16299 202.2
[M+H-H2O]+ 395.19709 189.0
[M+HCOO]- 457.19803 216.6
[M+CH3COO]- 471.21368 225.5
[M+Na-2H]- 433.17450 199.1
[M]+ 412.19928 203.7
[M]- 412.20038 203.7
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.