CID 132366730

3-(aminomethyl)thiophene-2-sulfonamide hydrochloride

Structural Information

Molecular Formula
C5H8N2O2S2
SMILES
C1=CSC(=C1CN)S(=O)(=O)N
InChI
InChI=1S/C5H8N2O2S2/c6-3-4-1-2-10-5(4)11(7,8)9/h1-2H,3,6H2,(H2,7,8,9)
InChIKey
DCWPOCAECDVEOW-UHFFFAOYSA-N
Compound name
3-(aminomethyl)thiophene-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.00272 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.01000 137.4
[M+Na]+ 214.99194 146.4
[M-H]- 190.99544 140.3
[M+NH4]+ 210.03654 158.1
[M+K]+ 230.96588 142.0
[M+H-H2O]+ 174.99998 131.9
[M+HCOO]- 237.00092 152.4
[M+CH3COO]- 251.01657 180.5
[M+Na-2H]- 212.97739 138.8
[M]+ 192.00217 137.2
[M]- 192.00327 137.2
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.