CID 16792798

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

Structural Information

Molecular Formula
C7H10N2O3S2
SMILES
CC(=O)NCC1=CC=C(S1)S(=O)(=O)N
InChI
InChI=1S/C7H10N2O3S2/c1-5(10)9-4-6-2-3-7(13-6)14(8,11)12/h2-3H,4H2,1H3,(H,9,10)(H2,8,11,12)
InChIKey
QFFRRRHCTJPLLZ-UHFFFAOYSA-N
Compound name
N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

234.01329 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.02057 149.5
[M+Na]+ 257.00251 157.3
[M-H]- 233.00601 152.6
[M+NH4]+ 252.04711 168.5
[M+K]+ 272.97645 153.3
[M+H-H2O]+ 217.01055 143.6
[M+HCOO]- 279.01149 163.8
[M+CH3COO]- 293.02714 188.4
[M+Na-2H]- 254.98796 150.2
[M]+ 234.01274 150.9
[M]- 234.01384 150.9
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