CID 47003266

3-(1h-pyrazol-1-yl)piperidine

Structural Information

Molecular Formula

C₈H₁₃N₃

SMILES

C1CC(CNC1)N2C=CC=N2

InChI

InChI=1S/C8H13N3/c1-3-8(7-9-4-1)11-6-2-5-10-11/h2,5-6,8-9H,1,3-4,7H2

InChIKey

OVEZWSXZQCHUEP-UHFFFAOYSA-N

Compound name

3-pyrazol-1-ylpiperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 35
Patents: 151.11095 Da
Monoisotopic Mass: 0.3
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]+	152.11823	134.1
[M+Na]+	174.10017	145.2
[M+NH4]+	169.14477	142.3
[M+K]+	190.07411	140.7
[M-H]-	150.10367	135.7
[M+Na-2H]-	172.08562	140.7
[M]+	151.11040	135.8
[M]-	151.11150	135.8

Literature stripe

literature stripe

Patent stripe

patents stripe