CID 45791161

1015846-40-8

Structural Information

Molecular Formula

C₉H₁₄N₂

SMILES

CCC(C1=C(C=CC=N1)C)N

InChI

InChI=1S/C9H14N2/c1-3-8(10)9-7(2)5-4-6-11-9/h4-6,8H,3,10H2,1-2H3

InChIKey

KYBITTXNIHENDH-UHFFFAOYSA-N

Compound name

1-(3-methylpyridin-2-yl)propan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 150.11569 Da
Monoisotopic Mass: 1.0
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]+	151.12297	132.8
[M+Na]+	173.10491	145.0
[M+NH4]+	168.14951	141.4
[M+K]+	189.07885	138.8
[M-H]-	149.10841	135.3
[M+Na-2H]-	171.09036	139.8
[M]+	150.11514	135.1
[M]-	150.11624	135.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.