CID 28924902

1909305-64-1

Structural Information

Molecular Formula

C₈H₁₂N₂

SMILES

CC1=CC(=NC=C1CN)C

InChI

InChI=1S/C8H12N2/c1-6-3-7(2)10-5-8(6)4-9/h3,5H,4,9H2,1-2H3

InChIKey

DCSKAVJDRSTGDL-UHFFFAOYSA-N

Compound name

(4,6-dimethylpyridin-3-yl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 124
Patents: 136.10005 Da
Monoisotopic Mass: 0.5
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]+	137.10733	127.7
[M+Na]+	159.08927	140.8
[M+NH4]+	154.13387	136.6
[M+K]+	175.06321	134.2
[M-H]-	135.09277	130.5
[M+Na-2H]-	157.07472	135.1
[M]+	136.09950	130.3
[M]-	136.10060	130.3

Literature stripe

literature stripe

Patent stripe

patents stripe