CID 156484

7,8-dichloro-2-dibenzofuranol

Structural Information

Molecular Formula
C12H6Cl2O2
SMILES
C1=CC2=C(C=C1O)C3=CC(=C(C=C3O2)Cl)Cl
InChI
InChI=1S/C12H6Cl2O2/c13-9-4-8-7-3-6(15)1-2-11(7)16-12(8)5-10(9)14/h1-5,15H
InChIKey
QFXILFJMBHEURG-UHFFFAOYSA-N
Compound name
7,8-dichlorodibenzofuran-2-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

251.97449 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.98177 148.4
[M+Na]+ 274.96371 162.9
[M-H]- 250.96721 154.0
[M+NH4]+ 270.00831 169.8
[M+K]+ 290.93765 156.9
[M+H-H2O]+ 234.97175 145.1
[M+HCOO]- 296.97269 162.1
[M+CH3COO]- 310.98834 163.0
[M+Na-2H]- 272.94916 155.6
[M]+ 251.97394 155.7
[M]- 251.97504 155.7
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

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