CID 60133962

Ethyl 2-(methyl(sulfamoyl)amino)acetate

Structural Information

Molecular Formula
C5H12N2O4S
SMILES
CCOC(=O)CN(C)S(=O)(=O)N
InChI
InChI=1S/C5H12N2O4S/c1-3-11-5(8)4-7(2)12(6,9)10/h3-4H2,1-2H3,(H2,6,9,10)
InChIKey
MDSZFZGHLMUOAF-UHFFFAOYSA-N
Compound name
ethyl 2-[methyl(sulfamoyl)amino]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

196.05177 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.05905 138.9
[M+Na]+ 219.04099 145.3
[M-H]- 195.04449 140.2
[M+NH4]+ 214.08559 158.2
[M+K]+ 235.01493 145.8
[M+H-H2O]+ 179.04903 133.0
[M+HCOO]- 241.04997 158.1
[M+CH3COO]- 255.06562 186.5
[M+Na-2H]- 217.02644 141.7
[M]+ 196.05122 142.7
[M]- 196.05232 142.7
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