CID 22500732

5-chlorofuran-2-sulfonyl chloride

Structural Information

Molecular Formula

C₄H₂Cl₂O₃S

SMILES

C1=C(OC(=C1)Cl)S(=O)(=O)Cl

InChI

InChI=1S/C4H2Cl2O3S/c5-3-1-2-4(9-3)10(6,7)8/h1-2H

InChIKey

SEHRKLAFSBAINR-UHFFFAOYSA-N

Compound name

5-chlorofuran-2-sulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 24
Patents: 199.91017 Da
Monoisotopic Mass: 2.3
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]+	200.91745	136.9
[M+Na]+	222.89939	149.3
[M+NH4]+	217.94399	145.4
[M+K]+	238.87333	143.9
[M-H]-	198.90289	138.1
[M+Na-2H]-	220.88484	141.2
[M]+	199.90962	140.0
[M]-	199.91072	140.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe