CID 19842653

3-bromothiophene-2-sulfonamide

Structural Information

Molecular Formula
C4H4BrNO2S2
SMILES
C1=CSC(=C1Br)S(=O)(=O)N
InChI
InChI=1S/C4H4BrNO2S2/c5-3-1-2-9-4(3)10(6,7)8/h1-2H,(H2,6,7,8)
InChIKey
RRCNZYMFYRZBMH-UHFFFAOYSA-N
Compound name
3-bromothiophene-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

68
Patents

240.88667 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.893946 128.3
[M+Na]+ 263.875888 142.7
[M-H]- 239.879394 135.0
[M+NH4]+ 258.920493 151.6
[M+K]+ 279.849828 129.9
[M+H-H2O]+ 223.883930 129.2
[M+HCOO]- 285.884871 141.9
[M+CH3COO]- 299.900521 183.6
[M+Na-2H]- 261.861336 133.1
[M]+ 240.88612142 148.0
[M]- 240.88721858 148.0
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

patents stripe