CID 15150046

(2-chloroethanesulfonyl)ethene

Structural Information

Molecular Formula

C₄H₇ClO₂S

SMILES

C=CS(=O)(=O)CCCl

InChI

InChI=1S/C4H7ClO2S/c1-2-8(6,7)4-3-5/h2H,1,3-4H2

InChIKey

XSFWXFNRRQJFKN-UHFFFAOYSA-N

Compound name

1-chloro-2-ethenylsulfonylethane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 153.98553 Da
Monoisotopic Mass: 0.7
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]+	154.99281	130.2
[M+Na]+	176.97475	141.0
[M+NH4]+	172.01935	138.2
[M+K]+	192.94869	133.6
[M-H]-	152.97825	128.7
[M+Na-2H]-	174.96020	133.3
[M]+	153.98498	131.9
[M]-	153.98608	131.9

Literature stripe

literature stripe

Patent stripe

patents stripe