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: 5
Patents: 196.05177 Da
Monoisotopic Mass: -0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	197.05905	141.5
[M+Na]+	219.04099	147.3
[M+NH4]+	214.08559	146.7
[M+K]+	235.01493	144.0
[M-H]-	195.04449	139.1
[M+Na-2H]-	217.02644	142.4
[M]+	196.05122	141.5
[M]-	196.05232	141.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe