CID 7460542

2-(4-benzyl-1-piperazinyl)-n'-(1-phenylethylidene)acetohydrazide

Structural Information

Molecular Formula
C21H26N4O
SMILES
C/C(=N\NC(=O)CN1CCN(CC1)CC2=CC=CC=C2)/C3=CC=CC=C3
InChI
InChI=1S/C21H26N4O/c1-18(20-10-6-3-7-11-20)22-23-21(26)17-25-14-12-24(13-15-25)16-19-8-4-2-5-9-19/h2-11H,12-17H2,1H3,(H,23,26)/b22-18+
InChIKey
YQNMPYWXABFYBW-RELWKKBWSA-N
Compound name
2-(4-benzylpiperazin-1-yl)-N-[(E)-1-phenylethylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.21066 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.21794 185.7
[M+Na]+ 373.19988 187.0
[M-H]- 349.20338 192.0
[M+NH4]+ 368.24448 194.6
[M+K]+ 389.17382 182.1
[M+H-H2O]+ 333.20792 173.5
[M+HCOO]- 395.20886 204.1
[M+CH3COO]- 409.22451 219.6
[M+Na-2H]- 371.18533 188.2
[M]+ 350.21011 180.6
[M]- 350.21121 180.6
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.