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

82
Patents

190.12184 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.12912 142.4
[M+Na]+ 213.11106 154.5
[M-H]- 189.11456 143.1
[M+NH4]+ 208.15566 159.9
[M+K]+ 229.08500 149.7
[M+H-H2O]+ 173.11910 134.7
[M+HCOO]- 235.12004 162.8
[M+CH3COO]- 249.13569 155.4
[M+Na-2H]- 211.09651 144.1
[M]+ 190.12129 143.1
[M]- 190.12239 143.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe