CID 46315027

4-methoxy-2-phenylpyridine

Structural Information

Molecular Formula

C₁₂H₁₁NO

SMILES

COC1=CC(=NC=C1)C2=CC=CC=C2

InChI

InChI=1S/C12H11NO/c1-14-11-7-8-13-12(9-11)10-5-3-2-4-6-10/h2-9H,1H3

InChIKey

OXUCGUHGNJQWMT-UHFFFAOYSA-N

Compound name

4-methoxy-2-phenylpyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 18
Patents: 185.08406 Da
Monoisotopic Mass: 2.8
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]+	186.09134	139.1
[M+Na]+	208.07328	155.3
[M+NH4]+	203.11788	148.8
[M+K]+	224.04722	146.9
[M-H]-	184.07678	144.1
[M+Na-2H]-	206.05873	150.4
[M]+	185.08351	143.0
[M]-	185.08461	143.0

Literature stripe

literature stripe

Patent stripe

patents stripe