CID 6447330

4-(3,4,5-trimethoxycinnamoyl)-2-piperazinone

Structural Information

Molecular Formula
C16H20N2O5
SMILES
COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)N2CCNC(=O)C2
InChI
InChI=1S/C16H20N2O5/c1-21-12-8-11(9-13(22-2)16(12)23-3)4-5-15(20)18-7-6-17-14(19)10-18/h4-5,8-9H,6-7,10H2,1-3H3,(H,17,19)/b5-4+
InChIKey
UEGPFBAXEXOTQV-SNAWJCMRSA-N
Compound name
4-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]piperazin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.1372 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.14448 175.2
[M+Na]+ 343.12642 185.8
[M+NH4]+ 338.17102 179.4
[M+K]+ 359.10036 181.1
[M-H]- 319.12992 175.1
[M+Na-2H]- 341.11187 178.3
[M]+ 320.13665 176.2
[M]- 320.13775 176.2
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.