CID 5532438

315182-84-4

Structural Information

Molecular Formula
C20H24N4O2
SMILES
C1CN(CCN1CC2=CC=CC=C2)CC(=O)N/N=C\C3=CC(=CC=C3)O
InChI
InChI=1S/C20H24N4O2/c25-19-8-4-7-18(13-19)14-21-22-20(26)16-24-11-9-23(10-12-24)15-17-5-2-1-3-6-17/h1-8,13-14,25H,9-12,15-16H2,(H,22,26)/b21-14-
InChIKey
PAULTJLCXCBRGJ-STZFKDTASA-N
Compound name
2-(4-benzylpiperazin-1-yl)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.1899 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.19718 186.5
[M+Na]+ 375.17912 197.8
[M+NH4]+ 370.22372 192.5
[M+K]+ 391.15306 190.3
[M-H]- 351.18262 191.8
[M+Na-2H]- 373.16457 194.6
[M]+ 352.18935 189.2
[M]- 352.19045 189.2
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.