CID 2774254

4-fluoro-1,2-diiodobenzene

Structural Information

Molecular Formula
C6H3FI2
SMILES
C1=CC(=C(C=C1F)I)I
InChI
InChI=1S/C6H3FI2/c7-4-1-2-5(8)6(9)3-4/h1-3H
InChIKey
YWDQZXYXZFFYJQ-UHFFFAOYSA-N
Compound name
4-fluoro-1,2-diiodobenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

347.8308 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.83808 131.8
[M+Na]+ 370.82002 126.9
[M-H]- 346.82352 122.9
[M+NH4]+ 365.86462 142.7
[M+K]+ 386.79396 136.6
[M+H-H2O]+ 330.82806 120.4
[M+HCOO]- 392.82900 144.1
[M+CH3COO]- 406.84465 197.7
[M+Na-2H]- 368.80547 121.1
[M]+ 347.83025 126.1
[M]- 347.83135 126.1
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