CID 124036946

1211524-68-3

Structural Information

Molecular Formula

C₁₀H₁₆N₂

SMILES

CC(C)(C)C1=C(N=CC=C1)CN

InChI

InChI=1S/C10H16N2/c1-10(2,3)8-5-4-6-12-9(8)7-11/h4-6H,7,11H2,1-3H3

InChIKey

GGKPYUOAMFEYCY-UHFFFAOYSA-N

Compound name

(3-tert-butyl-2-pyridinyl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 164.13135 Da
Monoisotopic Mass: 1.4
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]+	165.138626	137.9
[M+Na]+	187.120568	145.7
[M-H]-	163.124074	140.0
[M+NH4]+	182.165173	157.3
[M+K]+	203.094508	143.4
[M+H-H2O]+	147.128610	131.9
[M+HCOO]-	209.129551	159.8
[M+CH3COO]-	223.145201	181.9
[M+Na-2H]-	185.106016	144.9
[M]+	164.13080142	136.8
[M]-	164.13189858	136.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe