CID 20459379

N-(3-sulfamoylpropyl)acetamide

Structural Information

Molecular Formula
C5H12N2O3S
SMILES
CC(=O)NCCCS(=O)(=O)N
InChI
InChI=1S/C5H12N2O3S/c1-5(8)7-3-2-4-11(6,9)10/h2-4H2,1H3,(H,7,8)(H2,6,9,10)
InChIKey
RUEWBKNYCFWUTH-UHFFFAOYSA-N
Compound name
N-(3-sulfamoylpropyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

180.05687 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.06415 136.3
[M+Na]+ 203.04609 142.8
[M-H]- 179.04959 136.2
[M+NH4]+ 198.09069 155.7
[M+K]+ 219.02003 141.2
[M+H-H2O]+ 163.05413 130.8
[M+HCOO]- 225.05507 154.8
[M+CH3COO]- 239.07072 181.0
[M+Na-2H]- 201.03154 139.6
[M]+ 180.05632 137.4
[M]- 180.05742 137.4
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