CID 769092

N-methylthiophene-2-sulfonamide

Structural Information

Molecular Formula
C5H7NO2S2
SMILES
CNS(=O)(=O)C1=CC=CS1
InChI
InChI=1S/C5H7NO2S2/c1-6-10(7,8)5-3-2-4-9-5/h2-4,6H,1H3
InChIKey
CTIGHRXLNNYNGU-UHFFFAOYSA-N
Compound name
N-methylthiophene-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

189
Patents

176.99182 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.999096 134.7
[M+Na]+ 199.981038 144.1
[M-H]- 175.984544 138.8
[M+NH4]+ 195.025643 156.9
[M+K]+ 215.954978 140.9
[M+H-H2O]+ 159.989080 129.7
[M+HCOO]- 221.990021 150.3
[M+CH3COO]- 236.005671 175.7
[M+Na-2H]- 197.966486 137.8
[M]+ 176.99127142 137.1
[M]- 176.99236858 137.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe