CID 63642251

2416234-77-8

Structural Information

Molecular Formula

C₉H₁₅N

SMILES

C#CCCC1CCCCN1

InChI

InChI=1S/C9H15N/c1-2-3-6-9-7-4-5-8-10-9/h1,9-10H,3-8H2

InChIKey

UXDNZOOPIVWGLY-UHFFFAOYSA-N

Compound name

2-but-3-ynylpiperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 137.12045 Da
Monoisotopic Mass: 1.6
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]+	138.12773	134.5
[M+Na]+	160.10967	145.0
[M+NH4]+	155.15427	139.6
[M+K]+	176.08361	135.3
[M-H]-	136.11317	127.9
[M+Na-2H]-	158.09512	136.6
[M]+	137.11990	133.2
[M]-	137.12100	133.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.