CID 12258425

Phenyl(piperidin-3-yl)methanol hydrochloride

Structural Information

Molecular Formula

C₁₂H₁₇NO

SMILES

C1CC(CNC1)C(C2=CC=CC=C2)O

InChI

InChI=1S/C12H17NO/c14-12(10-5-2-1-3-6-10)11-7-4-8-13-9-11/h1-3,5-6,11-14H,4,7-9H2

InChIKey

LRMSJSMBPXSCCK-UHFFFAOYSA-N

Compound name

phenyl(piperidin-3-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 191.13101 Da
Monoisotopic Mass: 1.4
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]+	192.13829	145.2
[M+Na]+	214.12023	156.7
[M+NH4]+	209.16483	153.8
[M+K]+	230.09417	150.1
[M-H]-	190.12373	148.2
[M+Na-2H]-	212.10568	152.2
[M]+	191.13046	147.5
[M]-	191.13156	147.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe