CID 297935

2,6-piperazinedione, 4-(3,4-dimethoxyphenethyl)-, hydrochloride

Structural Information

Molecular Formula
C14H18N2O4
SMILES
COC1=C(C=C(C=C1)CCN2CC(=O)NC(=O)C2)OC
InChI
InChI=1S/C14H18N2O4/c1-19-11-4-3-10(7-12(11)20-2)5-6-16-8-13(17)15-14(18)9-16/h3-4,7H,5-6,8-9H2,1-2H3,(H,15,17,18)
InChIKey
JECXVTBFHXMZLZ-UHFFFAOYSA-N
Compound name
4-[2-(3,4-dimethoxyphenyl)ethyl]piperazine-2,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

278.12665 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.13393 164.8
[M+Na]+ 301.11587 176.6
[M+NH4]+ 296.16047 170.3
[M+K]+ 317.08981 171.0
[M-H]- 277.11937 165.8
[M+Na-2H]- 299.10132 169.2
[M]+ 278.12610 166.4
[M]- 278.12720 166.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.