CID 656936

2-(4-hydroxy-phenyl)benzofuran-5-ol

Structural Information

Molecular Formula
C14H10O3
SMILES
C1=CC(=CC=C1C2=CC3=C(O2)C=CC(=C3)O)O
InChI
InChI=1S/C14H10O3/c15-11-3-1-9(2-4-11)14-8-10-7-12(16)5-6-13(10)17-14/h1-8,15-16H
InChIKey
SNNNDCMXZYWCCI-UHFFFAOYSA-N
Compound name
2-(4-hydroxyphenyl)-1-benzofuran-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

23
Patents

226.06299 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.070266 145.2
[M+Na]+ 249.052208 156.2
[M-H]- 225.055714 152.5
[M+NH4]+ 244.096813 164.0
[M+K]+ 265.026148 152.6
[M+H-H2O]+ 209.060250 139.6
[M+HCOO]- 271.061191 168.4
[M+CH3COO]- 285.076841 159.5
[M+Na-2H]- 247.037656 152.6
[M]+ 226.06244142 147.9
[M]- 226.06353858 147.9
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