CID 61686283

2-methyl-1-(pyrrolidin-2-ylmethyl)-1h-imidazole

Structural Information

Molecular Formula

C₉H₁₅N₃

SMILES

CC1=NC=CN1CC2CCCN2

InChI

InChI=1S/C9H15N3/c1-8-10-5-6-12(8)7-9-3-2-4-11-9/h5-6,9,11H,2-4,7H2,1H3

InChIKey

LGXDFHZIAJFYAJ-UHFFFAOYSA-N

Compound name

2-methyl-1-(pyrrolidin-2-ylmethyl)imidazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 165.1266 Da
Monoisotopic Mass: 0.5
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]+	166.13388	138.0
[M+Na]+	188.11582	148.2
[M+NH4]+	183.16042	145.8
[M+K]+	204.08976	145.9
[M-H]-	164.11932	139.0
[M+Na-2H]-	186.10127	143.2
[M]+	165.12605	139.4
[M]-	165.12715	139.4

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.