CID 736802

67686-01-5

Structural Information

Molecular Formula

C₁₃H₁₉NO

SMILES

C1CN(CCC1CO)CC2=CC=CC=C2

InChI

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

InChIKey

FLQPYEOKVZYXRL-UHFFFAOYSA-N

Compound name

(1-benzylpiperidin-4-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 285
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]+	206.15395	148.9
[M+Na]+	228.13589	161.5
[M+NH4]+	223.18049	157.9
[M+K]+	244.10983	153.7
[M-H]-	204.13939	152.7
[M+Na-2H]-	226.12134	156.5
[M]+	205.14612	151.7
[M]-	205.14722	151.7

Literature stripe

literature stripe

Patent stripe

patents stripe