CID 6445284

4-(3,4-dimethoxycinnamoyl)-1-piperazineacetic acid ethyl ester hydrochloride

Structural Information

Molecular Formula
C19H26N2O5
SMILES
CCOC(=O)CN1CCN(CC1)C(=O)/C=C/C2=CC(=C(C=C2)OC)OC
InChI
InChI=1S/C19H26N2O5/c1-4-26-19(23)14-20-9-11-21(12-10-20)18(22)8-6-15-5-7-16(24-2)17(13-15)25-3/h5-8,13H,4,9-12,14H2,1-3H3/b8-6+
InChIKey
QKFFONDSLLENNI-SOFGYWHQSA-N
Compound name
ethyl 2-[4-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]piperazin-1-yl]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.18417 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.19145 187.0
[M+Na]+ 385.17339 196.8
[M+NH4]+ 380.21799 190.9
[M+K]+ 401.14733 191.8
[M-H]- 361.17689 187.1
[M+Na-2H]- 383.15884 189.9
[M]+ 362.18362 187.9
[M]- 362.18472 187.9
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.