CID 15664

1762-34-1

Structural Information

Molecular Formula

C₁₂H₁₂N₂

SMILES

CC1=CN=C(C=C1)C2=NC=C(C=C2)C

InChI

InChI=1S/C12H12N2/c1-9-3-5-11(13-7-9)12-6-4-10(2)8-14-12/h3-8H,1-2H3

InChIKey

PTRATZCAGVBFIQ-UHFFFAOYSA-N

Compound name

5-methyl-2-(5-methylpyridin-2-yl)pyridine

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 51
References: 1290
Patents: 184.10005 Da
Monoisotopic Mass: 2.2
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]+	185.10733	140.1
[M+Na]+	207.08927	156.9
[M+NH4]+	202.13387	149.5
[M+K]+	223.06321	148.4
[M-H]-	183.09277	144.7
[M+Na-2H]-	205.07472	151.1
[M]+	184.09950	144.0
[M]-	184.10060	144.0

Literature stripe

literature stripe

Patent stripe

patents stripe