CID 91655

Chlorethoxyfos

Structural Information

Molecular Formula
C6H11Cl4O3PS
SMILES
CCOP(=S)(OCC)OC(C(Cl)(Cl)Cl)Cl
InChI
InChI=1S/C6H11Cl4O3PS/c1-3-11-14(15,12-4-2)13-5(7)6(8,9)10/h5H,3-4H2,1-2H3
InChIKey
XFDJMIHUAHSGKG-UHFFFAOYSA-N
Compound name
diethoxy-sulfanylidene-(1,2,2,2-tetrachloroethoxy)-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

3
References

20956
Patents

333.89206 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.89934 158.3
[M+Na]+ 356.88128 165.9
[M-H]- 332.88478 156.7
[M+NH4]+ 351.92588 174.5
[M+K]+ 372.85522 161.7
[M+H-H2O]+ 316.88932 155.5
[M+HCOO]- 378.89026 159.3
[M+CH3COO]- 392.90591 203.0
[M+Na-2H]- 354.86673 157.5
[M]+ 333.89151 165.5
[M]- 333.89261 165.5
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.