CID 22224977

(4-benzylpiperidin-4-yl)methanol hydrochloride

Structural Information

Molecular Formula

C₁₃H₁₉NO

SMILES

C1CNCCC1(CC2=CC=CC=C2)CO

InChI

InChI=1S/C13H19NO/c15-11-13(6-8-14-9-7-13)10-12-4-2-1-3-5-12/h1-5,14-15H,6-11H2

InChIKey

CJLRAHJQICUTEV-UHFFFAOYSA-N

Compound name

(4-benzylpiperidin-4-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 42
Patents: 205.14667 Da
Monoisotopic Mass: 1.7
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]+	206.15395	150.0
[M+Na]+	228.13589	161.8
[M+NH4]+	223.18049	160.0
[M+K]+	244.10983	152.5
[M-H]-	204.13939	153.2
[M+Na-2H]-	226.12134	158.7
[M]+	205.14612	152.7
[M]-	205.14722	152.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe