CID 23118852

2-oxoethane-1-sulfonamide

Structural Information

Molecular Formula
C2H5NO3S
SMILES
C(C=O)S(=O)(=O)N
InChI
InChI=1S/C2H5NO3S/c3-7(5,6)2-1-4/h1H,2H2,(H2,3,5,6)
InChIKey
OWTUSYDFBOOMLH-UHFFFAOYSA-N
Compound name
2-oxoethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

66
Patents

122.999016 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.00629 119.0
[M+Na]+ 145.98823 127.9
[M-H]- 121.99174 119.5
[M+NH4]+ 141.03284 141.1
[M+K]+ 161.96217 126.8
[M+H-H2O]+ 105.99628 114.6
[M+HCOO]- 167.99722 138.5
[M+CH3COO]- 182.01287 166.6
[M+Na-2H]- 143.97368 124.4
[M]+ 122.99847 120.6
[M]- 122.99956 120.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe