CID 58155015

2,5-dibromo-4-iodopyridine

Structural Information

Molecular Formula
C5H2Br2IN
SMILES
C1=C(C(=CN=C1Br)Br)I
InChI
InChI=1S/C5H2Br2IN/c6-3-2-9-5(7)1-4(3)8/h1-2H
InChIKey
JHAWIJLEDSUTBA-UHFFFAOYSA-N
Compound name
2,5-dibromo-4-iodopyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

360.75986 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.76714 132.1
[M+Na]+ 383.74908 138.9
[M-H]- 359.75258 132.9
[M+NH4]+ 378.79368 148.0
[M+K]+ 399.72302 129.1
[M+H-H2O]+ 343.75712 137.2
[M+HCOO]- 405.75806 144.9
[M+CH3COO]- 419.77371 203.3
[M+Na-2H]- 381.73453 132.0
[M]+ 360.75931 162.1
[M]- 360.76041 162.1
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