CID 135635817

2-(4-benzyl-1-piperazinyl)-n'-(5-bromo-2-hydroxybenzylidene)acetohydrazide

Structural Information

Molecular Formula
C20H23BrN4O2
SMILES
C1CN(CCN1CC2=CC=CC=C2)CC(=O)N/N=C/C3=C(C=CC(=C3)Br)O
InChI
InChI=1S/C20H23BrN4O2/c21-18-6-7-19(26)17(12-18)13-22-23-20(27)15-25-10-8-24(9-11-25)14-16-4-2-1-3-5-16/h1-7,12-13,26H,8-11,14-15H2,(H,23,27)/b22-13+
InChIKey
DHCLBERZVVRAGZ-LPYMAVHISA-N
Compound name
2-(4-benzylpiperazin-1-yl)-N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

430.10043 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 431.10771 194.1
[M+Na]+ 453.08965 196.2
[M+NH4]+ 448.13425 196.6
[M+K]+ 469.06359 194.9
[M-H]- 429.09315 197.3
[M+Na-2H]- 451.07510 198.0
[M]+ 430.09988 193.9
[M]- 430.10098 193.9
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.