CID 3062954

Alpha-(2-hydroxy-1-phenylethyl)-4-phenyl-1-piperazinepropanoic acid hydrazide

Structural Information

Molecular Formula
C21H28N4O2
SMILES
C1CN(CCN1CC(C(CO)C2=CC=CC=C2)C(=O)NN)C3=CC=CC=C3
InChI
InChI=1S/C21H28N4O2/c22-23-21(27)19(20(16-26)17-7-3-1-4-8-17)15-24-11-13-25(14-12-24)18-9-5-2-6-10-18/h1-10,19-20,26H,11-16,22H2,(H,23,27)
InChIKey
VRHWHSUEWVBZRB-UHFFFAOYSA-N
Compound name
4-hydroxy-3-phenyl-2-[(4-phenylpiperazin-1-yl)methyl]butanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

368.22122 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.22850 190.7
[M+Na]+ 391.21044 199.8
[M+NH4]+ 386.25504 196.0
[M+K]+ 407.18438 194.2
[M-H]- 367.21394 195.0
[M+Na-2H]- 389.19589 197.2
[M]+ 368.22067 192.7
[M]- 368.22177 192.7
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.