CID 4060876

1,9-dibromo-2,8-dimethoxydibenzofuran

Structural Information

Molecular Formula

C₁₄H₁₀Br₂O₃

SMILES

COC1=C(C2=C(C=C1)OC3=C2C(=C(C=C3)OC)Br)Br

InChI

InChI=1S/C14H10Br2O3/c1-17-9-5-3-7-11(13(9)15)12-8(19-7)4-6-10(18-2)14(12)16/h3-6H,1-2H3

InChIKey

MNHOLBJNRVWNRV-UHFFFAOYSA-N

Compound name

1,9-dibromo-2,8-dimethoxydibenzofuran

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 383.89966 Da
Monoisotopic Mass: 5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	384.906936	163.6
[M+Na]+	406.888878	176.9
[M-H]-	382.892384	173.2
[M+NH4]+	401.933483	182.7
[M+K]+	422.862818	163.9
[M+H-H2O]+	366.896920	172.0
[M+HCOO]-	428.897861	179.8
[M+CH3COO]-	442.913511	178.2
[M+Na-2H]-	404.874326	170.4
[M]+	383.89911142	203.4
[M]-	383.90020858	203.4

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.