CID 9588024

1-piperazineacetic acid, 4-phenyl-, (phenylmethylene)hydrazide

Structural Information

Molecular Formula
C19H22N4O
SMILES
C1CN(CCN1CC(=O)N/N=C/C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H22N4O/c24-19(21-20-15-17-7-3-1-4-8-17)16-22-11-13-23(14-12-22)18-9-5-2-6-10-18/h1-10,15H,11-14,16H2,(H,21,24)/b20-15+
InChIKey
WVHHSBJNSDZDSC-HMMYKYKNSA-N
Compound name
N-[(E)-benzylideneamino]-2-(4-phenylpiperazin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.17935 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.186626 176.8
[M+Na]+ 345.168568 179.3
[M-H]- 321.172074 183.3
[M+NH4]+ 340.213173 186.9
[M+K]+ 361.142508 174.2
[M+H-H2O]+ 305.176610 164.8
[M+HCOO]- 367.177551 196.9
[M+CH3COO]- 381.193201 212.8
[M+Na-2H]- 343.154016 181.5
[M]+ 322.17880142 171.6
[M]- 322.17989858 171.6
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.