CID 96790

69286-06-2

Structural Information

Molecular Formula

C₁₀H₁₄N₄

SMILES

CC1=C(N=C(N1)C2=NC(=C(N2)C)C)C

InChI

InChI=1S/C10H14N4/c1-5-6(2)12-9(11-5)10-13-7(3)8(4)14-10/h1-4H3,(H,11,12)(H,13,14)

InChIKey

YDDBHCXOIBPIFS-UHFFFAOYSA-N

Compound name

2-(4,5-dimethyl-1H-imidazol-2-yl)-4,5-dimethyl-1H-imidazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 81
Patents: 190.12184 Da
Monoisotopic Mass: 1.5
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]+	191.12912	142.7
[M+Na]+	213.11106	155.7
[M+NH4]+	208.15566	149.4
[M+K]+	229.08500	154.0
[M-H]-	189.11456	143.1
[M+Na-2H]-	211.09651	148.6
[M]+	190.12129	144.5
[M]-	190.12239	144.5

Literature stripe

literature stripe

Patent stripe

patents stripe