CID 9626698

2-(4-benzyl-1-piperazinyl)-n'-(1-(3,4-dichlorophenyl)ethylidene)acetohydrazide

Structural Information

Molecular Formula
C21H24Cl2N4O
SMILES
C/C(=N\NC(=O)CN1CCN(CC1)CC2=CC=CC=C2)/C3=CC(=C(C=C3)Cl)Cl
InChI
InChI=1S/C21H24Cl2N4O/c1-16(18-7-8-19(22)20(23)13-18)24-25-21(28)15-27-11-9-26(10-12-27)14-17-5-3-2-4-6-17/h2-8,13H,9-12,14-15H2,1H3,(H,25,28)/b24-16+
InChIKey
LZOBLXPOSLTMBO-LFVJCYFKSA-N
Compound name
2-(4-benzylpiperazin-1-yl)-N-[(E)-1-(3,4-dichlorophenyl)ethylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

418.13272 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 419.14000 198.9
[M+Na]+ 441.12194 212.5
[M+NH4]+ 436.16654 205.9
[M+K]+ 457.09588 203.1
[M-H]- 417.12544 204.8
[M+Na-2H]- 439.10739 207.0
[M]+ 418.13217 202.9
[M]- 418.13327 202.9
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.