CID 12410823

Iodomethanesulfonyl chloride

Structural Information

Molecular Formula

SMILES

C(S(=O)(=O)Cl)I

InChI

InChI=1S/CH2ClIO2S/c2-6(4,5)1-3/h1H2

InChIKey

HLVPPXHUMMLBLD-UHFFFAOYSA-N

Compound name

iodomethanesulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 239.85088 Da
Monoisotopic Mass: 1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	240.85816	127.3
[M+Na]+	262.84010	130.7
[M-H]-	238.84360	122.2
[M+NH4]+	257.88470	145.6
[M+K]+	278.81404	134.2
[M+H-H2O]+	222.84814	121.1
[M+HCOO]-	284.84908	137.3
[M+CH3COO]-	298.86473	174.7
[M+Na-2H]-	260.82555	120.9
[M]+	239.85033	128.7
[M]-	239.85143	128.7

Literature stripe

literature stripe

Patent stripe

patents stripe