CID 92633709

1380711-18-1

Structural Information

Molecular Formula
C24H28N4O
SMILES
C1CN(CCC1CC(=O)NC2=CC(=CC=C2)N3C=CC=N3)CCC4=CC=CC=C4
InChI
InChI=1S/C24H28N4O/c29-24(26-22-8-4-9-23(19-22)28-14-5-13-25-28)18-21-11-16-27(17-12-21)15-10-20-6-2-1-3-7-20/h1-9,13-14,19,21H,10-12,15-18H2,(H,26,29)
InChIKey
OUYMRUXQSQFHTF-UHFFFAOYSA-N
Compound name
2-[1-(2-phenylethyl)piperidin-4-yl]-N-(3-pyrazol-1-ylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

388.22632 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.23360 194.9
[M+Na]+ 411.21554 197.1
[M-H]- 387.21904 202.0
[M+NH4]+ 406.26014 202.1
[M+K]+ 427.18948 190.2
[M+H-H2O]+ 371.22358 181.6
[M+HCOO]- 433.22452 211.1
[M+CH3COO]- 447.24017 201.7
[M+Na-2H]- 409.20099 194.6
[M]+ 388.22577 190.0
[M]- 388.22687 190.0
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.