CID 43133893

N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide

Structural Information

Molecular Formula
C8H12N2O3S2
SMILES
CC(=O)NCCC1=CC=C(S1)S(=O)(=O)N
InChI
InChI=1S/C8H12N2O3S2/c1-6(11)10-5-4-7-2-3-8(14-7)15(9,12)13/h2-3H,4-5H2,1H3,(H,10,11)(H2,9,12,13)
InChIKey
CHQIACJKJNFSLB-UHFFFAOYSA-N
Compound name
N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.02893 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.036206 153.7
[M+Na]+ 271.018148 161.0
[M-H]- 247.021654 156.6
[M+NH4]+ 266.062753 172.2
[M+K]+ 286.992088 156.8
[M+H-H2O]+ 231.026190 147.6
[M+HCOO]- 293.027131 167.7
[M+CH3COO]- 307.042781 191.3
[M+Na-2H]- 269.003596 154.0
[M]+ 248.02838142 155.5
[M]- 248.02947858 155.5
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

No patent data available for this compound.