CID 11019291

4-methyl-2,2'-bipyridine

Structural Information

Molecular Formula

C₁₁H₁₀N₂

SMILES

CC1=CC(=NC=C1)C2=CC=CC=N2

InChI

InChI=1S/C11H10N2/c1-9-5-7-13-11(8-9)10-4-2-3-6-12-10/h2-8H,1H3

InChIKey

OHSRAWAUPZWNKY-UHFFFAOYSA-N

Compound name

4-methyl-2-pyridin-2-ylpyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 373
Patents: 170.0844 Da
Monoisotopic Mass: 2.1
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]+	171.091676	134.9
[M+Na]+	193.073618	143.9
[M-H]-	169.077124	139.1
[M+NH4]+	188.118223	152.5
[M+K]+	209.047558	140.3
[M+H-H2O]+	153.081660	126.5
[M+HCOO]-	215.082601	157.6
[M+CH3COO]-	229.098251	148.4
[M+Na-2H]-	191.059066	144.1
[M]+	170.08385142	134.3
[M]-	170.08494858	134.3

Literature stripe

literature stripe

Patent stripe

patents stripe