CID 15421854

1(bis-4-methoxyphenyl)-phenylmethyl-benzimidazole

Structural Information

Molecular Formula
C28H24N2O2
SMILES
COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)N4C=NC5=CC=CC=C54
InChI
InChI=1S/C28H24N2O2/c1-31-24-16-12-22(13-17-24)28(21-8-4-3-5-9-21,23-14-18-25(32-2)19-15-23)30-20-29-26-10-6-7-11-27(26)30/h3-20H,1-2H3
InChIKey
WUSLDCFMHZRKEG-UHFFFAOYSA-N
Compound name
1-[bis(4-methoxyphenyl)-phenylmethyl]benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

420.18378 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.19106 205.8
[M+Na]+ 443.17300 213.4
[M-H]- 419.17650 216.7
[M+NH4]+ 438.21760 214.6
[M+K]+ 459.14694 206.0
[M+H-H2O]+ 403.18104 193.3
[M+HCOO]- 465.18198 225.0
[M+CH3COO]- 479.19763 214.8
[M+Na-2H]- 441.15845 210.1
[M]+ 420.18323 208.7
[M]- 420.18433 208.7
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.