CID 63970258

2361644-77-9

Structural Information

Molecular Formula

C₉H₁₁N₃

SMILES

C1CNCC=C1C2=NC=CN=C2

InChI

InChI=1S/C9H11N3/c1-3-10-4-2-8(1)9-7-11-5-6-12-9/h1,5-7,10H,2-4H2

InChIKey

XUIRHKCTPDRCEQ-UHFFFAOYSA-N

Compound name

2-(1,2,3,6-tetrahydropyridin-4-yl)pyrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 161.09529 Da
Monoisotopic Mass: -0.4
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]+	162.102566	134.7
[M+Na]+	184.084508	141.0
[M-H]-	160.088014	135.1
[M+NH4]+	179.129113	150.0
[M+K]+	200.058448	137.2
[M+H-H2O]+	144.092550	125.6
[M+HCOO]-	206.093491	152.2
[M+CH3COO]-	220.109141	145.9
[M+Na-2H]-	182.069956	143.1
[M]+	161.09474142	128.7
[M]-	161.09583858	128.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe