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]+ 197.059046 138.9
[M+Na]+ 219.040988 145.3
[M-H]- 195.044494 140.2
[M+NH4]+ 214.085593 158.2
[M+K]+ 235.014928 145.8
[M+H-H2O]+ 179.049030 133.0
[M+HCOO]- 241.049971 158.1
[M+CH3COO]- 255.065621 186.5
[M+Na-2H]- 217.026436 141.7
[M]+ 196.05122142 142.7
[M]- 196.05231858 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