CID 455450

Piperid ph-bis deriv.

Structural Information

Molecular Formula
C18H28N2O2
SMILES
C1CN(CCC1O)CC2=CC=C(C=C2)CN3CCC(CC3)O
InChI
InChI=1S/C18H28N2O2/c21-17-5-9-19(10-6-17)13-15-1-2-16(4-3-15)14-20-11-7-18(22)8-12-20/h1-4,17-18,21-22H,5-14H2
InChIKey
SENQBZROPDCLAX-UHFFFAOYSA-N
Compound name
1-[[4-[(4-hydroxypiperidin-1-yl)methyl]phenyl]methyl]piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

304.2151 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.22238 176.8
[M+Na]+ 327.20432 178.5
[M-H]- 303.20782 179.0
[M+NH4]+ 322.24892 186.8
[M+K]+ 343.17826 173.2
[M+H-H2O]+ 287.21236 166.5
[M+HCOO]- 349.21330 187.1
[M+CH3COO]- 363.22895 200.1
[M+Na-2H]- 325.18977 175.9
[M]+ 304.21455 167.3
[M]- 304.21565 167.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.