CID 56972623

Pyridine, 2-(1z)-1-butenyl-

Structural Information

Molecular Formula

C₉H₁₃N

SMILES

C/C=C\CN1CC=CC=C1

InChI

InChI=1S/C9H13N/c1-2-3-7-10-8-5-4-6-9-10/h2-6,8H,7,9H2,1H3/b3-2-

InChIKey

BKWFANKRKVPPHO-IHWYPQMZSA-N

Compound name

1-[(Z)-but-2-enyl]-2H-pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 135.1048 Da
Monoisotopic Mass: 2.2
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]+	136.11208	129.9
[M+Na]+	158.09402	142.9
[M+NH4]+	153.13862	139.1
[M+K]+	174.06796	135.0
[M-H]-	134.09752	132.1
[M+Na-2H]-	156.07947	137.3
[M]+	135.10425	132.3
[M]-	135.10535	132.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.