CID 34370

2-imidazoline, 2-hexyl-

Structural Information

Molecular Formula

C₉H₁₈N₂

SMILES

CCCCCCC1=NCCN1

InChI

InChI=1S/C9H18N2/c1-2-3-4-5-6-9-10-7-8-11-9/h2-8H2,1H3,(H,10,11)

InChIKey

IUXYHFKKNJXGSI-UHFFFAOYSA-N

Compound name

2-hexyl-4,5-dihydro-1H-imidazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 154.147 Da
Monoisotopic Mass: 1.7
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]+	155.15428	137.4
[M+Na]+	177.13622	147.4
[M+NH4]+	172.18082	145.2
[M+K]+	193.11016	142.4
[M-H]-	153.13972	137.4
[M+Na-2H]-	175.12167	141.7
[M]+	154.14645	138.5
[M]-	154.14755	138.5

Literature stripe

literature stripe

Patent stripe

patents stripe