CID 7728394

871666-58-9

Structural Information

Molecular Formula
C20H24N2
SMILES
CC1=CC2=C(C=C1C)N(C=N2)CC3=CC=C(C=C3)C(C)(C)C
InChI
InChI=1S/C20H24N2/c1-14-10-18-19(11-15(14)2)22(13-21-18)12-16-6-8-17(9-7-16)20(3,4)5/h6-11,13H,12H2,1-5H3
InChIKey
BQYNIPRKHAMXMM-UHFFFAOYSA-N
Compound name
1-[(4-tert-butylphenyl)methyl]-5,6-dimethylbenzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.19394 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.20122 172.7
[M+Na]+ 315.18316 189.1
[M+NH4]+ 310.22776 181.6
[M+K]+ 331.15710 182.0
[M-H]- 291.18666 177.1
[M+Na-2H]- 313.16861 181.4
[M]+ 292.19339 176.7
[M]- 292.19449 176.7
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.