CID 5284462

Tetrachlorvinphos

Structural Information

Molecular Formula
C10H9Cl4O4P
SMILES
COP(=O)(OC)O/C(=C\Cl)/C1=CC(=C(C=C1Cl)Cl)Cl
InChI
InChI=1S/C10H9Cl4O4P/c1-16-19(15,17-2)18-10(5-11)6-3-8(13)9(14)4-7(6)12/h3-5H,1-2H3/b10-5-
InChIKey
UBCKGWBNUIFUST-YHYXMXQVSA-N
Compound name
[(Z)-2-chloro-1-(2,4,5-trichlorophenyl)ethenyl] dimethyl phosphate
Related CIDs

2D Structure

compound 2d structure
9
Annotation Hits

140
References

31651
Patents

363.89926 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.90654 163.8
[M+Na]+ 386.88848 174.4
[M-H]- 362.89198 164.9
[M+NH4]+ 381.93308 179.0
[M+K]+ 402.86242 169.5
[M+H-H2O]+ 346.89652 159.8
[M+HCOO]- 408.89746 171.4
[M+CH3COO]- 422.91311 210.1
[M+Na-2H]- 384.87393 163.4
[M]+ 363.89871 172.0
[M]- 363.89981 172.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe