CID 135558933

303107-52-0

Structural Information

Molecular Formula
C20H24N4O2
SMILES
C1CN(CCN1CC2=CC=CC=C2)CC(=O)N/N=C/C3=CC=C(C=C3)O
InChI
InChI=1S/C20H24N4O2/c25-19-8-6-17(7-9-19)14-21-22-20(26)16-24-12-10-23(11-13-24)15-18-4-2-1-3-5-18/h1-9,14,25H,10-13,15-16H2,(H,22,26)/b21-14+
InChIKey
GRQAZVXHVSCMCW-KGENOOAVSA-N
Compound name
2-(4-benzylpiperazin-1-yl)-N-[(E)-(4-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]+ 353.197176 184.4
[M+Na]+ 375.179118 186.8
[M-H]- 351.182624 189.9
[M+NH4]+ 370.223723 192.9
[M+K]+ 391.153058 181.5
[M+H-H2O]+ 335.187160 172.6
[M+HCOO]- 397.188101 202.9
[M+CH3COO]- 411.203751 216.8
[M+Na-2H]- 373.164566 187.6
[M]+ 352.18935142 179.6
[M]- 352.19044858 179.6
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.