CID 21344428

N-(2-iodoethyl)methanesulfonamide

Structural Information

Molecular Formula
C3H8INO2S
SMILES
CS(=O)(=O)NCCI
InChI
InChI=1S/C3H8INO2S/c1-8(6,7)5-3-2-4/h5H,2-3H2,1H3
InChIKey
QRJDRGVAXTXUOE-UHFFFAOYSA-N
Compound name
N-(2-iodoethyl)methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

248.93205 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.93933 140.6
[M+Na]+ 271.92127 141.6
[M-H]- 247.92477 134.8
[M+NH4]+ 266.96587 157.3
[M+K]+ 287.89521 146.2
[M+H-H2O]+ 231.92931 132.2
[M+HCOO]- 293.93025 154.8
[M+CH3COO]- 307.94590 181.2
[M+Na-2H]- 269.90672 133.3
[M]+ 248.93150 140.2
[M]- 248.93260 140.2
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