CID 96480

2168-16-3

Structural Information

Molecular Formula

C₁₁H₁₆N₂O

SMILES

C1CCN(CC1)CC2=C(C=CC=N2)O

InChI

InChI=1S/C11H16N2O/c14-11-5-4-6-12-10(11)9-13-7-2-1-3-8-13/h4-6,14H,1-3,7-9H2

InChIKey

BMRGAJCUJCTATP-UHFFFAOYSA-N

Compound name

2-(piperidin-1-ylmethyl)pyridin-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 6
Patents: 192.12627 Da
Monoisotopic Mass: 1.2
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]+	193.13355	144.4
[M+Na]+	215.11549	157.2
[M+NH4]+	210.16009	152.8
[M+K]+	231.08943	150.1
[M-H]-	191.11899	147.4
[M+Na-2H]-	213.10094	152.0
[M]+	192.12572	147.0
[M]-	192.12682	147.0

Literature stripe

literature stripe

Patent stripe

patents stripe