CID 6445268

N-ethyl-4'-(3,4,5-trimethoxycinnamoyl)-1-piperazineacetamide hydrochloride

Structural Information

Molecular Formula
C20H29N3O5
SMILES
CCNC(=O)CN1CCN(CC1)C(=O)/C=C/C2=CC(=C(C(=C2)OC)OC)OC
InChI
InChI=1S/C20H29N3O5/c1-5-21-18(24)14-22-8-10-23(11-9-22)19(25)7-6-15-12-16(26-2)20(28-4)17(13-15)27-3/h6-7,12-13H,5,8-11,14H2,1-4H3,(H,21,24)/b7-6+
InChIKey
LWTFYIFOMIPIQI-VOTSOKGWSA-N
Compound name
N-ethyl-2-[4-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]piperazin-1-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

391.21072 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 392.21800 194.8
[M+Na]+ 414.19994 198.4
[M-H]- 390.20344 197.7
[M+NH4]+ 409.24454 203.0
[M+K]+ 430.17388 195.9
[M+H-H2O]+ 374.20798 184.6
[M+HCOO]- 436.20892 210.8
[M+CH3COO]- 450.22457 224.1
[M+Na-2H]- 412.18539 192.6
[M]+ 391.21017 197.2
[M]- 391.21127 197.2
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.