CID 3070139

Brn 4582091

Structural Information

Molecular Formula
C24H32N4O
SMILES
C1CCN=C(C1)NC2=CC=C(C=C2)OCCCN3CCN(CC3)C4=CC=CC=C4
InChI
InChI=1S/C24H32N4O/c1-2-7-22(8-3-1)28-18-16-27(17-19-28)15-6-20-29-23-12-10-21(11-13-23)26-24-9-4-5-14-25-24/h1-3,7-8,10-13H,4-6,9,14-20H2,(H,25,26)
InChIKey
PPIBGKOEENAPFP-UHFFFAOYSA-N
Compound name
N-[4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-2,3,4,5-tetrahydropyridin-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

392.2576 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 393.26488 197.5
[M+Na]+ 415.24682 197.8
[M-H]- 391.25032 203.0
[M+NH4]+ 410.29142 202.4
[M+K]+ 431.22076 190.9
[M+H-H2O]+ 375.25486 182.9
[M+HCOO]- 437.25580 210.6
[M+CH3COO]- 451.27145 202.8
[M+Na-2H]- 413.23227 199.2
[M]+ 392.25705 189.9
[M]- 392.25815 189.9
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.