CID 373076

85573-17-7

Structural Information

Molecular Formula
C20H16N2O2
SMILES
C1=CC=C2C(=C1)N=C(N2CC3=CC=C(C=C3)O)C4=CC=C(C=C4)O
InChI
InChI=1S/C20H16N2O2/c23-16-9-5-14(6-10-16)13-22-19-4-2-1-3-18(19)21-20(22)15-7-11-17(24)12-8-15/h1-12,23-24H,13H2
InChIKey
UCPIAPAZIWRDBJ-UHFFFAOYSA-N
Compound name
4-[[2-(4-hydroxyphenyl)benzimidazol-1-yl]methyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

7
Patents

316.1212 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.12848 173.7
[M+Na]+ 339.11042 183.9
[M-H]- 315.11392 180.4
[M+NH4]+ 334.15502 186.8
[M+K]+ 355.08436 176.4
[M+H-H2O]+ 299.11846 164.3
[M+HCOO]- 361.11940 193.9
[M+CH3COO]- 375.13505 184.9
[M+Na-2H]- 337.09587 178.3
[M]+ 316.12065 174.9
[M]- 316.12175 174.9
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.