CID 8292

Fensulfothion

Structural Information

Molecular Formula

C₁₁H₁₇O₄PS₂

SMILES

CCOP(=S)(OCC)OC1=CC=C(C=C1)S(=O)C

InChI

InChI=1S/C11H17O4PS2/c1-4-13-16(17,14-5-2)15-10-6-8-11(9-7-10)18(3)12/h6-9H,4-5H2,1-3H3

InChIKey

XDNBJTQLKCIJBV-UHFFFAOYSA-N

Compound name

diethoxy-(4-methylsulfinylphenoxy)-sulfanylidene-lambda5-phosphane

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 16
References: 12223
Patents: 308.03058 Da
Monoisotopic Mass: 2.2
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]+	309.03786	163.4
[M+Na]+	331.01980	172.4
[M+NH4]+	326.06440	170.0
[M+K]+	346.99374	164.6
[M-H]-	307.02330	163.3
[M+Na-2H]-	329.00525	166.5
[M]+	308.03003	165.4
[M]-	308.03113	165.4

Literature stripe

literature stripe

Patent stripe

patents stripe