CID 11638680

3,4-dibromothiophene-2-sulfonyl chloride

Structural Information

Molecular Formula

C₄HBr₂ClO₂S₂

SMILES

C1=C(C(=C(S1)S(=O)(=O)Cl)Br)Br

InChI

InChI=1S/C4HBr2ClO2S2/c5-2-1-10-4(3(2)6)11(7,8)9/h1H

InChIKey

OLSYJMFARDELRE-UHFFFAOYSA-N

Compound name

3,4-dibromothiophene-2-sulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 18
Patents: 337.7473 Da
Monoisotopic Mass: 3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	338.75458	129.5
[M+Na]+	360.73652	124.6
[M+NH4]+	355.78112	132.1
[M+K]+	376.71046	131.1
[M-H]-	336.74002	129.6
[M+Na-2H]-	358.72197	131.1
[M]+	337.74675	128.4
[M]-	337.74785	128.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe