CID 202521

10560-23-3

Structural Information

Molecular Formula
C24H32N2O2
SMILES
C1CCN(CC1)CC2=C(C=CC(=C2)C3=CC(=C(C=C3)O)CN4CCCCC4)O
InChI
InChI=1S/C24H32N2O2/c27-23-9-7-19(15-21(23)17-25-11-3-1-4-12-25)20-8-10-24(28)22(16-20)18-26-13-5-2-6-14-26/h7-10,15-16,27-28H,1-6,11-14,17-18H2
InChIKey
KJSLTUMJIPXMHI-UHFFFAOYSA-N
Compound name
4-[4-hydroxy-3-(piperidin-1-ylmethyl)phenyl]-2-(piperidin-1-ylmethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

380.24637 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.25365 199.0
[M+Na]+ 403.23559 212.2
[M+NH4]+ 398.28019 206.4
[M+K]+ 419.20953 203.3
[M-H]- 379.23909 205.8
[M+Na-2H]- 401.22104 206.8
[M]+ 380.24582 202.8
[M]- 380.24692 202.8
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.