CID 12521510

3-bromo-2-iodofuran

Structural Information

Molecular Formula
C4H2BrIO
SMILES
C1=COC(=C1Br)I
InChI
InChI=1S/C4H2BrIO/c5-3-1-2-7-4(3)6/h1-2H
InChIKey
HTSODYWNVCMVCF-UHFFFAOYSA-N
Compound name
3-bromo-2-iodofuran
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

271.83337 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.84065 134.0
[M+Na]+ 294.82259 140.6
[M-H]- 270.82609 134.8
[M+NH4]+ 289.86719 153.9
[M+K]+ 310.79653 137.9
[M+H-H2O]+ 254.83063 131.7
[M+HCOO]- 316.83157 152.5
[M+CH3COO]- 330.84722 182.2
[M+Na-2H]- 292.80804 131.5
[M]+ 271.83282 150.2
[M]- 271.83392 150.2
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