CID 13739741

5-(pyridin-3-yl)pentan-2-amine

Structural Information

Molecular Formula

C₁₀H₁₆N₂

SMILES

CC(CCCC1=CN=CC=C1)N

InChI

InChI=1S/C10H16N2/c1-9(11)4-2-5-10-6-3-7-12-8-10/h3,6-9H,2,4-5,11H2,1H3

InChIKey

FVWVJTJAALVOQO-UHFFFAOYSA-N

Compound name

5-pyridin-3-ylpentan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 60
Patents: 164.13135 Da
Monoisotopic Mass: 1.1
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]+	165.13863	138.0
[M+Na]+	187.12057	143.9
[M-H]-	163.12407	139.3
[M+NH4]+	182.16517	156.7
[M+K]+	203.09451	141.6
[M+H-H2O]+	147.12861	130.9
[M+HCOO]-	209.12955	160.3
[M+CH3COO]-	223.14520	182.0
[M+Na-2H]-	185.10602	143.8
[M]+	164.13080	136.3
[M]-	164.13190	136.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe