CID 2760014

2-(m-tolyl)pyridine

Structural Information

Molecular Formula

C₁₂H₁₁N

SMILES

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

InChI

InChI=1S/C12H11N/c1-10-5-4-6-11(9-10)12-7-2-3-8-13-12/h2-9H,1H3

InChIKey

JMTCQDNRTSGBGC-UHFFFAOYSA-N

Compound name

2-(3-methylphenyl)pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 532
Patents: 169.08914 Da
Monoisotopic Mass: 3.0
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]+	170.09642	135.7
[M+Na]+	192.07836	152.4
[M+NH4]+	187.12296	146.0
[M+K]+	208.05230	143.5
[M-H]-	168.08186	141.2
[M+Na-2H]-	190.06381	147.5
[M]+	169.08859	139.9
[M]-	169.08969	139.9

Literature stripe

literature stripe

Patent stripe

patents stripe