CID 14771148

124800-33-5

Structural Information

Molecular Formula

C₁₀H₁₆N₂

SMILES

CC(C)(C)C1=NC=C(C=C1)CN

InChI

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

InChIKey

BZVICEFUBGIHDR-UHFFFAOYSA-N

Compound name

(6-tert-butylpyridin-3-yl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 24
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]+	165.13863	137.9
[M+Na]+	187.12057	145.7
[M-H]-	163.12407	140.0
[M+NH4]+	182.16517	157.3
[M+K]+	203.09451	143.4
[M+H-H2O]+	147.12861	131.9
[M+HCOO]-	209.12955	159.8
[M+CH3COO]-	223.14520	181.9
[M+Na-2H]-	185.10602	144.9
[M]+	164.13080	136.8
[M]-	164.13190	136.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe