CID 6884827

2-(4-benzyl-1-piperazinyl)-n'-(3-phenyl-2-propenylidene)acetohydrazide

Structural Information

Molecular Formula
C22H26N4O
SMILES
C1CN(CCN1CC2=CC=CC=C2)CC(=O)N/N=C/C=C/C3=CC=CC=C3
InChI
InChI=1S/C22H26N4O/c27-22(24-23-13-7-12-20-8-3-1-4-9-20)19-26-16-14-25(15-17-26)18-21-10-5-2-6-11-21/h1-13H,14-19H2,(H,24,27)/b12-7+,23-13+
InChIKey
UECDLYDMSLAUBB-ZUSHJTOUSA-N
Compound name
2-(4-benzylpiperazin-1-yl)-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.21066 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.21794 189.1
[M+Na]+ 385.19988 190.6
[M-H]- 361.20338 195.1
[M+NH4]+ 380.24448 197.6
[M+K]+ 401.17382 184.3
[M+H-H2O]+ 345.20792 176.6
[M+HCOO]- 407.20886 208.4
[M+CH3COO]- 421.22451 220.3
[M+Na-2H]- 383.18533 192.2
[M]+ 362.21011 184.1
[M]- 362.21121 184.1
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.