CID 141281895

En300-1987315

Structural Information

Molecular Formula
C7H7Cl2NO2S
SMILES
C1=CN=C(C=C1CCS(=O)(=O)Cl)Cl
InChI
InChI=1S/C7H7Cl2NO2S/c8-7-5-6(1-3-10-7)2-4-13(9,11)12/h1,3,5H,2,4H2
InChIKey
VKSYBRQNZHWMLO-UHFFFAOYSA-N
Compound name
2-(2-chloropyridin-4-yl)ethanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.95746 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.96474 142.4
[M+Na]+ 261.94668 153.3
[M-H]- 237.95018 145.1
[M+NH4]+ 256.99128 160.8
[M+K]+ 277.92062 148.0
[M+H-H2O]+ 221.95472 138.2
[M+HCOO]- 283.95566 150.7
[M+CH3COO]- 297.97131 184.2
[M+Na-2H]- 259.93213 147.1
[M]+ 238.95691 148.1
[M]- 238.95801 148.1
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

No patent data available for this compound.