CID 9298

Fenchlorphos

Structural Information

Molecular Formula

C₈H₈Cl₃O₃PS

SMILES

COP(=S)(OC)OC1=CC(=C(C=C1Cl)Cl)Cl

InChI

InChI=1S/C8H8Cl3O3PS/c1-12-15(16,13-2)14-8-4-6(10)5(9)3-7(8)11/h3-4H,1-2H3

InChIKey

JHJOOSLFWRRSGU-UHFFFAOYSA-N

Compound name

dimethoxy-sulfanylidene-(2,4,5-trichlorophenoxy)-lambda5-phosphane

Related CIDs

2D Structure

compound 2d structure

8
Annotation Hits: 40
References: 9197
Patents: 319.89975 Da
Monoisotopic Mass: 5.1
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]+	320.90703	163.5
[M+Na]+	342.88897	176.8
[M+NH4]+	337.93357	171.4
[M+K]+	358.86291	168.3
[M-H]-	318.89247	163.9
[M+Na-2H]-	340.87442	168.1
[M]+	319.89920	166.8
[M]-	319.90030	166.8

Literature stripe

literature stripe

Patent stripe

patents stripe