CID 15879265

1-(2,6-diisopropylphenyl)imidazole

Structural Information

Molecular Formula
C15H20N2
SMILES
CC(C)C1=C(C(=CC=C1)C(C)C)N2C=CN=C2
InChI
InChI=1S/C15H20N2/c1-11(2)13-6-5-7-14(12(3)4)15(13)17-9-8-16-10-17/h5-12H,1-4H3
InChIKey
OWSXDWUAPKBLOI-UHFFFAOYSA-N
Compound name
1-[2,6-di(propan-2-yl)phenyl]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

241
Patents

228.16264 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.169916 154.5
[M+Na]+ 251.151858 162.0
[M-H]- 227.155364 158.7
[M+NH4]+ 246.196463 171.9
[M+K]+ 267.125798 158.7
[M+H-H2O]+ 211.159900 146.2
[M+HCOO]- 273.160841 174.7
[M+CH3COO]- 287.176491 194.3
[M+Na-2H]- 249.137306 155.7
[M]+ 228.16209142 155.3
[M]- 228.16318858 155.3
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