CID 26278

1'-benzyl-4'-phenyl-1,4'-bipiperidine dihydrochloride

Structural Information

Molecular Formula
C23H30N2
SMILES
C1CCN(CC1)C2(CCN(CC2)CC3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C23H30N2/c1-4-10-21(11-5-1)20-24-18-14-23(15-19-24,22-12-6-2-7-13-22)25-16-8-3-9-17-25/h1-2,4-7,10-13H,3,8-9,14-20H2
InChIKey
VZMOXEBMLLRLGG-UHFFFAOYSA-N
Compound name
1-benzyl-4-phenyl-4-piperidin-1-ylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

334.2409 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.24818 186.2
[M+Na]+ 357.23012 187.0
[M-H]- 333.23362 193.1
[M+NH4]+ 352.27472 197.0
[M+K]+ 373.20406 180.7
[M+H-H2O]+ 317.23816 172.8
[M+HCOO]- 379.23910 198.5
[M+CH3COO]- 393.25475 192.9
[M+Na-2H]- 355.21557 187.7
[M]+ 334.24035 175.5
[M]- 334.24145 175.5
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

patents stripe