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
8
Annotation Hits

16
References

13212
Patents

308.03058 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.03786 162.4
[M+Na]+ 331.01980 168.9
[M-H]- 307.02330 164.5
[M+NH4]+ 326.06440 178.3
[M+K]+ 346.99374 165.7
[M+H-H2O]+ 291.02784 153.3
[M+HCOO]- 353.02878 179.8
[M+CH3COO]- 367.04443 201.3
[M+Na-2H]- 329.00525 160.7
[M]+ 308.03003 170.0
[M]- 308.03113 170.0
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