CID 10857943

2-(2,2-dibromovinyl)furan

Structural Information

Molecular Formula
C6H4Br2O
SMILES
C1=COC(=C1)C=C(Br)Br
InChI
InChI=1S/C6H4Br2O/c7-6(8)4-5-2-1-3-9-5/h1-4H
InChIKey
HEVJQAUMWQPCHR-UHFFFAOYSA-N
Compound name
2-(2,2-dibromoethenyl)furan
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

249.86288 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.870156 137.2
[M+Na]+ 272.852098 148.5
[M-H]- 248.855604 144.6
[M+NH4]+ 267.896703 158.2
[M+K]+ 288.826038 134.8
[M+H-H2O]+ 232.860140 145.8
[M+HCOO]- 294.861081 154.0
[M+CH3COO]- 308.876731 194.2
[M+Na-2H]- 270.837546 144.5
[M]+ 249.86233142 171.1
[M]- 249.86342858 171.1
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