CID 70262

2-ethyl-4-methylimidazole

Structural Information

Molecular Formula

C₆H₁₀N₂

SMILES

CCC1=NC=C(N1)C

InChI

InChI=1S/C6H10N2/c1-3-6-7-4-5(2)8-6/h4H,3H2,1-2H3,(H,7,8)

InChIKey

ULKLGIFJWFIQFF-UHFFFAOYSA-N

Compound name

2-ethyl-5-methyl-1H-imidazole

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 6
References: 65368
Patents: 110.0844 Da
Monoisotopic Mass: 1.3
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]+	111.09168	121.8
[M+Na]+	133.07362	133.7
[M+NH4]+	128.11822	130.2
[M+K]+	149.04756	129.6
[M-H]-	109.07712	122.2
[M+Na-2H]-	131.05907	127.7
[M]+	110.08385	123.4
[M]-	110.08495	123.4

Literature stripe

literature stripe

Patent stripe

patents stripe