CID 135625871

2-(4-benzyl-1-piperazinyl)-n'-(1-(4-hydroxyphenyl)propylidene)acetohydrazide

Structural Information

Molecular Formula
C22H28N4O2
SMILES
CC/C(=N\NC(=O)CN1CCN(CC1)CC2=CC=CC=C2)/C3=CC=C(C=C3)O
InChI
InChI=1S/C22H28N4O2/c1-2-21(19-8-10-20(27)11-9-19)23-24-22(28)17-26-14-12-25(13-15-26)16-18-6-4-3-5-7-18/h3-11,27H,2,12-17H2,1H3,(H,24,28)/b23-21+
InChIKey
VSDBXRAXULZYQQ-XTQSDGFTSA-N
Compound name
2-(4-benzylpiperazin-1-yl)-N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

380.22122 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.22850 193.2
[M+Na]+ 403.21044 194.3
[M-H]- 379.21394 198.3
[M+NH4]+ 398.25504 200.4
[M+K]+ 419.18438 189.2
[M+H-H2O]+ 363.21848 181.2
[M+HCOO]- 425.21942 210.0
[M+CH3COO]- 439.23507 223.6
[M+Na-2H]- 401.19589 194.2
[M]+ 380.22067 188.5
[M]- 380.22177 188.5
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.