CID 6006405

1-cinnamyl-4-acetylpiperazine hydrochloride

Structural Information

Molecular Formula
C15H20N2O
SMILES
CC(=O)N1CCN(CC1)C/C=C/C2=CC=CC=C2
InChI
InChI=1S/C15H20N2O/c1-14(18)17-12-10-16(11-13-17)9-5-8-15-6-3-2-4-7-15/h2-8H,9-13H2,1H3/b8-5+
InChIKey
IXFLEYAVUQUPCA-VMPITWQZSA-N
Compound name
1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

244.15756 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.16484 159.6
[M+Na]+ 267.14678 164.0
[M-H]- 243.15028 162.1
[M+NH4]+ 262.19138 173.7
[M+K]+ 283.12072 159.9
[M+H-H2O]+ 227.15482 150.3
[M+HCOO]- 289.15576 176.2
[M+CH3COO]- 303.17141 192.4
[M+Na-2H]- 265.13223 162.2
[M]+ 244.15701 155.3
[M]- 244.15811 155.3
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

patents stripe