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]+ 249.03621 153.7
[M+Na]+ 271.01815 161.0
[M-H]- 247.02165 156.6
[M+NH4]+ 266.06275 172.2
[M+K]+ 286.99209 156.8
[M+H-H2O]+ 231.02619 147.6
[M+HCOO]- 293.02713 167.7
[M+CH3COO]- 307.04278 191.3
[M+Na-2H]- 269.00360 154.0
[M]+ 248.02838 155.5
[M]- 248.02948 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.