CID 11645053

1,3-dibromo-2,4-dimethoxybenzene

Structural Information

Molecular Formula
C8H8Br2O2
SMILES
COC1=C(C(=C(C=C1)Br)OC)Br
InChI
InChI=1S/C8H8Br2O2/c1-11-6-4-3-5(9)8(12-2)7(6)10/h3-4H,1-2H3
InChIKey
UZFUWYMMUGVSCE-UHFFFAOYSA-N
Compound name
1,3-dibromo-2,4-dimethoxybenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

293.8891 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.89638 146.5
[M+Na]+ 316.87832 142.3
[M+NH4]+ 311.92292 148.7
[M+K]+ 332.85226 148.5
[M-H]- 292.88182 147.4
[M+Na-2H]- 314.86377 148.3
[M]+ 293.88855 145.1
[M]- 293.88965 145.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe