CID 9877419

258874-61-2

Structural Information

Molecular Formula

C₉H₁₄N₂

SMILES

CC(C)(C)NC1=CC=NC=C1

InChI

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

InChIKey

AJAXVUZVKSSAAU-UHFFFAOYSA-N

Compound name

N-tert-butylpyridin-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 101
Patents: 150.11569 Da
Monoisotopic Mass: 1.8
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	133.0
[M+Na]+	173.10491	140.2
[M-H]-	149.10841	135.4
[M+NH4]+	168.14951	152.9
[M+K]+	189.07885	138.5
[M+H-H2O]+	133.11295	126.8
[M+HCOO]-	195.11389	155.8
[M+CH3COO]-	209.12954	178.4
[M+Na-2H]-	171.09036	142.3
[M]+	150.11514	132.2
[M]-	150.11624	132.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe