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

literature stripe

Patent stripe

patents stripe