CID 88964

1-(3-pyridyl)-3,3-diethyltriazene

Structural Information

Molecular Formula

C₉H₁₄N₄

SMILES

CCN(CC)N=NC1=CN=CC=C1

InChI

InChI=1S/C9H14N4/c1-3-13(4-2)12-11-9-6-5-7-10-8-9/h5-8H,3-4H2,1-2H3

InChIKey

MCAIXMIIMYVJOQ-UHFFFAOYSA-N

Compound name

N-ethyl-N-(pyridin-3-yldiazenyl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 11
Patents: 178.12184 Da
Monoisotopic Mass: 2.3
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]+	179.12912	139.2
[M+Na]+	201.11106	150.4
[M+NH4]+	196.15566	147.7
[M+K]+	217.08500	143.6
[M-H]-	177.11456	143.6
[M+Na-2H]-	199.09651	147.9
[M]+	178.12129	141.8
[M]-	178.12239	141.8

Literature stripe

literature stripe

Patent stripe

patents stripe