CID 171145632

Refchem:411581

Structural Information

Molecular Formula
C7H11Cl3O4S
SMILES
CCOC(C(=C(S(=O)(=O)Cl)Cl)Cl)OCC
InChI
InChI=1S/C7H11Cl3O4S/c1-3-13-7(14-4-2)5(8)6(9)15(10,11)12/h7H,3-4H2,1-2H3
InChIKey
FSLDIDPPXSGUAZ-UHFFFAOYSA-N
Compound name
1,2-dichloro-3,3-diethoxyprop-1-ene-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.94437 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.95165 151.1
[M+Na]+ 318.93359 158.7
[M-H]- 294.93709 151.1
[M+NH4]+ 313.97819 168.3
[M+K]+ 334.90753 154.7
[M+H-H2O]+ 278.94163 149.9
[M+HCOO]- 340.94257 152.1
[M+CH3COO]- 354.95822 195.2
[M+Na-2H]- 316.91904 150.8
[M]+ 295.94382 158.5
[M]- 295.94492 158.5
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.