CID 2733924

5-bromothiophene-2-sulfonyl chloride

Structural Information

Molecular Formula
C4H2BrClO2S2
SMILES
C1=C(SC(=C1)Br)S(=O)(=O)Cl
InChI
InChI=1S/C4H2BrClO2S2/c5-3-1-2-4(9-3)10(6,7)8/h1-2H
InChIKey
WGYBIEOLAFYDEC-UHFFFAOYSA-N
Compound name
5-bromothiophene-2-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

902
Patents

259.83682 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.84410 128.6
[M+Na]+ 282.82604 131.1
[M+NH4]+ 277.87064 134.3
[M+K]+ 298.79998 130.6
[M-H]- 258.82954 128.2
[M+Na-2H]- 280.81149 131.0
[M]+ 259.83627 128.7
[M]- 259.83737 128.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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