CID 3066235

M.g. 16226

Structural Information

Molecular Formula
C26H32N4O2
SMILES
C1CC(N(C(=O)C1)CCCN2CCC(CC2)N3C4=CC=CC=C4NC3=O)C5=CC=CC=C5
InChI
InChI=1S/C26H32N4O2/c31-25-13-6-12-23(20-8-2-1-3-9-20)29(25)17-7-16-28-18-14-21(15-19-28)30-24-11-5-4-10-22(24)27-26(30)32/h1-5,8-11,21,23H,6-7,12-19H2,(H,27,32)
InChIKey
WKAPCKAPKAHQKI-UHFFFAOYSA-N
Compound name
3-[1-[3-(2-oxo-6-phenylpiperidin-1-yl)propyl]piperidin-4-yl]-1H-benzimidazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

432.25253 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 433.25981 209.7
[M+Na]+ 455.24175 223.8
[M+NH4]+ 450.28635 215.8
[M+K]+ 471.21569 216.5
[M-H]- 431.24525 215.3
[M+Na-2H]- 453.22720 216.5
[M]+ 432.25198 213.1
[M]- 432.25308 213.1
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.