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

50
Patents

240.88667 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.89395 125.3
[M+Na]+ 263.87589 125.8
[M+NH4]+ 258.92049 130.2
[M+K]+ 279.84983 126.7
[M-H]- 239.87939 124.9
[M+Na-2H]- 261.86134 127.3
[M]+ 240.88612 124.7
[M]- 240.88722 124.7
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