CID 458259

Dibenzofuran-3,4-diol

Structural Information

Molecular Formula
C12H8O3
SMILES
C1=CC=C2C(=C1)C3=C(O2)C(=C(C=C3)O)O
InChI
InChI=1S/C12H8O3/c13-9-6-5-8-7-3-1-2-4-10(7)15-12(8)11(9)14/h1-6,13-14H
InChIKey
POCSNBZIGFHXSI-UHFFFAOYSA-N
Compound name
dibenzofuran-3,4-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

200.04735 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.05463 136.6
[M+Na]+ 223.03657 148.6
[M-H]- 199.04007 141.8
[M+NH4]+ 218.08117 157.9
[M+K]+ 239.01051 145.3
[M+H-H2O]+ 183.04461 132.1
[M+HCOO]- 245.04555 158.9
[M+CH3COO]- 259.06120 151.5
[M+Na-2H]- 221.02202 145.9
[M]+ 200.04680 140.0
[M]- 200.04790 140.0
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