CID 6445292

N,n-diisopropyl-4'-(3,4,5-trimethoxycinnamoyl)-1-piperazineacetamide maleate

Structural Information

Molecular Formula
C24H37N3O5
SMILES
CC(C)N(C(C)C)C(=O)CN1CCN(CC1)C(=O)/C=C/C2=CC(=C(C(=C2)OC)OC)OC
InChI
InChI=1S/C24H37N3O5/c1-17(2)27(18(3)4)23(29)16-25-10-12-26(13-11-25)22(28)9-8-19-14-20(30-5)24(32-7)21(15-19)31-6/h8-9,14-15,17-18H,10-13,16H2,1-7H3/b9-8+
InChIKey
QLLDVSFWFCEDCS-CMDGGOBGSA-N
Compound name
N,N-di(propan-2-yl)-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

447.27332 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 448.28060 209.8
[M+Na]+ 470.26254 211.3
[M-H]- 446.26604 213.6
[M+NH4]+ 465.30714 216.2
[M+K]+ 486.23648 210.6
[M+H-H2O]+ 430.27058 199.5
[M+HCOO]- 492.27152 223.0
[M+CH3COO]- 506.28717 240.8
[M+Na-2H]- 468.24799 203.0
[M]+ 447.27277 213.8
[M]- 447.27387 213.8
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.