CID 74890239

4-ethynyl-n-methylpyridin-2-amine

Structural Information

Molecular Formula

C₈H₈N₂

SMILES

CNC1=NC=CC(=C1)C#C

InChI

InChI=1S/C8H8N2/c1-3-7-4-5-10-8(6-7)9-2/h1,4-6H,2H3,(H,9,10)

InChIKey

QQFOHRYTTREWLV-UHFFFAOYSA-N

Compound name

4-ethynyl-N-methylpyridin-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 132.06874 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]+	133.07602	128.9
[M+Na]+	155.05796	141.6
[M+NH4]+	150.10256	134.1
[M+K]+	171.03190	131.9
[M-H]-	131.06146	123.4
[M+Na-2H]-	153.04341	133.7
[M]+	132.06819	128.3
[M]-	132.06929	128.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe