CID 118153

Alpha-methyl-4-phenylpiperidine-4-methanol

Structural Information

Molecular Formula

C₁₃H₁₉NO

SMILES

CC(C1(CCNCC1)C2=CC=CC=C2)O

InChI

InChI=1S/C13H19NO/c1-11(15)13(7-9-14-10-8-13)12-5-3-2-4-6-12/h2-6,11,14-15H,7-10H2,1H3

InChIKey

KZCXJZTWPDOBTQ-UHFFFAOYSA-N

Compound name

1-(4-phenylpiperidin-4-yl)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 205.14667 Da
Monoisotopic Mass: 1.8
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]+	206.153946	149.6
[M+Na]+	228.135888	153.4
[M-H]-	204.139394	151.2
[M+NH4]+	223.180493	167.1
[M+K]+	244.109828	149.7
[M+H-H2O]+	188.143930	142.6
[M+HCOO]-	250.144871	164.9
[M+CH3COO]-	264.160521	180.0
[M+Na-2H]-	226.121336	154.0
[M]+	205.14612142	141.9
[M]-	205.14721858	141.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe