CID 43420051

5-(2-aminoethyl)-n,n-diethylthiophene-2-sulfonamide

Structural Information

Molecular Formula
C10H18N2O2S2
SMILES
CCN(CC)S(=O)(=O)C1=CC=C(S1)CCN
InChI
InChI=1S/C10H18N2O2S2/c1-3-12(4-2)16(13,14)10-6-5-9(15-10)7-8-11/h5-6H,3-4,7-8,11H2,1-2H3
InChIKey
WSZQEGQNZQIXFR-UHFFFAOYSA-N
Compound name
5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.08096 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.08824 159.2
[M+Na]+ 285.07018 166.1
[M-H]- 261.07368 163.3
[M+NH4]+ 280.11478 178.1
[M+K]+ 301.04412 162.5
[M+H-H2O]+ 245.07822 152.7
[M+HCOO]- 307.07916 173.7
[M+CH3COO]- 321.09481 199.1
[M+Na-2H]- 283.05563 158.8
[M]+ 262.08041 163.0
[M]- 262.08151 163.0
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.