CID 3039652

50910-26-4

Structural Information

Molecular Formula
C20H25NO2
SMILES
C1CCN(CC1)CCC(C2=CC=C(C=C2)C3=CC=C(C=C3)O)O
InChI
InChI=1S/C20H25NO2/c22-19-10-8-17(9-11-19)16-4-6-18(7-5-16)20(23)12-15-21-13-2-1-3-14-21/h4-11,20,22-23H,1-3,12-15H2
InChIKey
ZTZOQOUSLPHACT-UHFFFAOYSA-N
Compound name
4-[4-(1-hydroxy-3-piperidin-1-ylpropyl)phenyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.18854 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.19582 176.1
[M+Na]+ 334.17776 178.7
[M-H]- 310.18126 180.3
[M+NH4]+ 329.22236 187.0
[M+K]+ 350.15170 173.1
[M+H-H2O]+ 294.18580 166.5
[M+HCOO]- 356.18674 190.4
[M+CH3COO]- 370.20239 201.8
[M+Na-2H]- 332.16321 176.9
[M]+ 311.18799 170.0
[M]- 311.18909 170.0
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.