CID 211489

Rc 61-92 hydrochloride

Structural Information

Molecular Formula

C₁₅H₂₃NO₂

SMILES

CC1CCN(CC1)C(C)C(C2=CC=C(C=C2)O)O

InChI

InChI=1S/C15H23NO2/c1-11-7-9-16(10-8-11)12(2)15(18)13-3-5-14(17)6-4-13/h3-6,11-12,15,17-18H,7-10H2,1-2H3

InChIKey

INRMERSRFDABLA-UHFFFAOYSA-N

Compound name

4-[1-hydroxy-2-(4-methylpiperidin-1-yl)propyl]phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 249.17288 Da
Monoisotopic Mass: 2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	250.180156	160.6
[M+Na]+	272.162098	164.0
[M-H]-	248.165604	162.2
[M+NH4]+	267.206703	174.7
[M+K]+	288.136038	160.7
[M+H-H2O]+	232.170140	153.0
[M+HCOO]-	294.171081	174.3
[M+CH3COO]-	308.186731	191.8
[M+Na-2H]-	270.147546	160.4
[M]+	249.17233142	154.9
[M]-	249.17342858	154.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.