CID 3076705

132287-17-3

Structural Information

Molecular Formula
C19H20N2
SMILES
CC1=C(C=C(C=C1)C(CC2=CN=CN2)C3=CC=CC=C3)C
InChI
InChI=1S/C19H20N2/c1-14-8-9-17(10-15(14)2)19(11-18-12-20-13-21-18)16-6-4-3-5-7-16/h3-10,12-13,19H,11H2,1-2H3,(H,20,21)
InChIKey
QXFWDEBLEBQVFW-UHFFFAOYSA-N
Compound name
5-[2-(3,4-dimethylphenyl)-2-phenylethyl]-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.16266 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.169936 166.7
[M+Na]+ 299.151878 173.5
[M-H]- 275.155384 172.4
[M+NH4]+ 294.196483 180.8
[M+K]+ 315.125818 167.1
[M+H-H2O]+ 259.159920 157.1
[M+HCOO]- 321.160861 186.4
[M+CH3COO]- 335.176511 177.4
[M+Na-2H]- 297.137326 168.7
[M]+ 276.16211142 165.0
[M]- 276.16320858 165.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.