CID 23467220

27652-91-1

Structural Information

Molecular Formula

C₁₃H₁₃NO₂

SMILES

COC1=CC=CC=C1C(C2=CC=CC=N2)O

InChI

InChI=1S/C13H13NO2/c1-16-12-8-3-2-6-10(12)13(15)11-7-4-5-9-14-11/h2-9,13,15H,1H3

InChIKey

RYTMGNRIMAHOFD-UHFFFAOYSA-N

Compound name

(2-methoxyphenyl)-pyridin-2-ylmethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 215.09464 Da
Monoisotopic Mass: 1.5
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]+	216.10192	146.7
[M+Na]+	238.08386	153.9
[M-H]-	214.08736	150.8
[M+NH4]+	233.12846	162.9
[M+K]+	254.05780	150.7
[M+H-H2O]+	198.09190	138.9
[M+HCOO]-	260.09284	168.1
[M+CH3COO]-	274.10849	185.1
[M+Na-2H]-	236.06931	153.0
[M]+	215.09409	146.7
[M]-	215.09519	146.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe