CID 121552768

[(chlorosulfonyl)imino](ethyl)methyl-lambda6-sulfanone

Structural Information

Molecular Formula
C3H8ClNO3S2
SMILES
CCS(=NS(=O)(=O)Cl)(=O)C
InChI
InChI=1S/C3H8ClNO3S2/c1-3-9(2,6)5-10(4,7)8/h3H2,1-2H3
InChIKey
NMOZNPCVAQIWIH-UHFFFAOYSA-N
Compound name
N-(ethyl-methyl-oxo-lambda6-sulfanylidene)sulfamoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.96341 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.97069 137.9
[M+Na]+ 227.95263 147.3
[M-H]- 203.95613 140.3
[M+NH4]+ 222.99723 158.5
[M+K]+ 243.92657 143.5
[M+H-H2O]+ 187.96067 134.1
[M+HCOO]- 249.96161 147.4
[M+CH3COO]- 263.97726 180.7
[M+Na-2H]- 225.93808 142.2
[M]+ 204.96286 143.3
[M]- 204.96396 143.3
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.