CID 43598240

N-[(1-aminocyclohexyl)methyl]thiophene-2-sulfonamide hydrochloride

Structural Information

Molecular Formula
C11H18N2O2S2
SMILES
C1CCC(CC1)(CNS(=O)(=O)C2=CC=CS2)N
InChI
InChI=1S/C11H18N2O2S2/c12-11(6-2-1-3-7-11)9-13-17(14,15)10-5-4-8-16-10/h4-5,8,13H,1-3,6-7,9,12H2
InChIKey
UBEIVCWJMLIKQA-UHFFFAOYSA-N
Compound name
N-[(1-aminocyclohexyl)methyl]thiophene-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.08096 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.088236 159.1
[M+Na]+ 297.070178 164.3
[M-H]- 273.073684 163.8
[M+NH4]+ 292.114783 178.2
[M+K]+ 313.044118 159.6
[M+H-H2O]+ 257.078220 153.6
[M+HCOO]- 319.079161 170.8
[M+CH3COO]- 333.094811 194.0
[M+Na-2H]- 295.055626 161.8
[M]+ 274.08041142 156.2
[M]- 274.08150858 156.2
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.