CID 119026535

4-chloro-3,5-diiodo-2-methylpyridine

Structural Information

Molecular Formula
C6H4ClI2N
SMILES
CC1=NC=C(C(=C1I)Cl)I
InChI
InChI=1S/C6H4ClI2N/c1-3-6(9)5(7)4(8)2-10-3/h2H,1H3
InChIKey
SQKGMABAEBSICQ-UHFFFAOYSA-N
Compound name
4-chloro-3,5-diiodo-2-methylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

378.81216 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.81944 133.1
[M+Na]+ 401.80138 129.6
[M-H]- 377.80488 124.3
[M+NH4]+ 396.84598 143.0
[M+K]+ 417.77532 138.1
[M+H-H2O]+ 361.80942 122.5
[M+HCOO]- 423.81036 141.8
[M+CH3COO]- 437.82601 201.5
[M+Na-2H]- 399.78683 122.5
[M]+ 378.81161 130.6
[M]- 378.81271 130.6
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

No patent data available for this compound.