CID 71591384

Bromo-[1-[(4-tert-butylphenyl)methyl]-3-[(2,4,6-trimethylphenyl)methyl]-2h-benzimidazol-2-yl]silver

Structural Information

Molecular Formula
C28H34N2
SMILES
CC1=CC(=C(C(=C1)C)CN2CN(C3=CC=CC=C32)CC4=CC=C(C=C4)C(C)(C)C)C
InChI
InChI=1S/C28H34N2/c1-20-15-21(2)25(22(3)16-20)18-30-19-29(26-9-7-8-10-27(26)30)17-23-11-13-24(14-12-23)28(4,5)6/h7-16H,17-19H2,1-6H3
InChIKey
GMTOADFEGZPRID-UHFFFAOYSA-N
Compound name
1-[(4-tert-butylphenyl)methyl]-3-[(2,4,6-trimethylphenyl)methyl]-2H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

398.2722 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 399.27948 206.8
[M+Na]+ 421.26142 214.7
[M-H]- 397.26492 214.8
[M+NH4]+ 416.30602 218.6
[M+K]+ 437.23536 206.8
[M+H-H2O]+ 381.26946 196.3
[M+HCOO]- 443.27040 222.2
[M+CH3COO]- 457.28605 215.7
[M+Na-2H]- 419.24687 204.9
[M]+ 398.27165 208.6
[M]- 398.27275 208.6
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.