CID 43363663

2-chloro-4-iodobenzene-1-sulfonyl chloride

Structural Information

Molecular Formula
C6H3Cl2IO2S
SMILES
C1=CC(=C(C=C1I)Cl)S(=O)(=O)Cl
InChI
InChI=1S/C6H3Cl2IO2S/c7-5-3-4(9)1-2-6(5)12(8,10)11/h1-3H
InChIKey
ICVMRDPGPFENNX-UHFFFAOYSA-N
Compound name
2-chloro-4-iodobenzenesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.82755 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.83483 144.4
[M+Na]+ 358.81677 149.2
[M-H]- 334.82027 142.1
[M+NH4]+ 353.86137 159.9
[M+K]+ 374.79071 149.8
[M+H-H2O]+ 318.82481 138.0
[M+HCOO]- 380.82575 149.9
[M+CH3COO]- 394.84140 190.9
[M+Na-2H]- 356.80222 137.2
[M]+ 335.82700 147.1
[M]- 335.82810 147.1
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

No patent data available for this compound.