CID 217336

Piperidine, 1-(4-piperidinophenethyl)-

Structural Information

Molecular Formula
C18H28N2
SMILES
C1CCN(CC1)CCC2=CC=C(C=C2)N3CCCCC3
InChI
InChI=1S/C18H28N2/c1-3-12-19(13-4-1)16-11-17-7-9-18(10-8-17)20-14-5-2-6-15-20/h7-10H,1-6,11-16H2
InChIKey
XOIWDEDWKCDWSE-UHFFFAOYSA-N
Compound name
1-[4-(2-piperidin-1-ylethyl)phenyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

8
Patents

272.22525 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.23253 169.4
[M+Na]+ 295.21447 170.1
[M-H]- 271.21797 173.4
[M+NH4]+ 290.25907 181.5
[M+K]+ 311.18841 165.3
[M+H-H2O]+ 255.22251 158.1
[M+HCOO]- 317.22345 182.2
[M+CH3COO]- 331.23910 177.1
[M+Na-2H]- 293.19992 170.6
[M]+ 272.22470 159.7
[M]- 272.22580 159.7
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.