CID 269231

2-(piperidin-1-yl)pyrazine

Structural Information

Molecular Formula

C₉H₁₃N₃

SMILES

C1CCN(CC1)C2=NC=CN=C2

InChI

InChI=1S/C9H13N3/c1-2-6-12(7-3-1)9-8-10-4-5-11-9/h4-5,8H,1-3,6-7H2

InChIKey

FMPQINQOBNERLC-UHFFFAOYSA-N

Compound name

2-piperidin-1-ylpyrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 360
Patents: 163.11095 Da
Monoisotopic Mass: 1.1
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]+	164.11823	135.9
[M+Na]+	186.10017	141.6
[M-H]-	162.10367	137.4
[M+NH4]+	181.14477	151.8
[M+K]+	202.07411	139.0
[M+H-H2O]+	146.10821	126.4
[M+HCOO]-	208.10915	153.5
[M+CH3COO]-	222.12480	147.3
[M+Na-2H]-	184.08562	143.7
[M]+	163.11040	130.4
[M]-	163.11150	130.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe