CID 65992943

1420975-94-5

Structural Information

Molecular Formula

C₉H₁₂N₂O

SMILES

C1C(CN1C2=CC=CC=N2)CO

InChI

InChI=1S/C9H12N2O/c12-7-8-5-11(6-8)9-3-1-2-4-10-9/h1-4,8,12H,5-7H2

InChIKey

SDNHCHZORARLRY-UHFFFAOYSA-N

Compound name

(1-pyridin-2-ylazetidin-3-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 164.09496 Da
Monoisotopic Mass: 0.7
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]+	165.10224	132.1
[M+Na]+	187.08418	140.6
[M+NH4]+	182.12878	136.4
[M+K]+	203.05812	136.5
[M-H]-	163.08768	131.6
[M+Na-2H]-	185.06963	137.4
[M]+	164.09441	131.9
[M]-	164.09551	131.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.