CID 66152

74-60-2

Structural Information

Molecular Formula
C13H21O4PS2
SMILES
CC(C)OP(=S)(OC1=CC=C(C=C1)S(=O)C)OC(C)C
InChI
InChI=1S/C13H21O4PS2/c1-10(2)15-18(19,16-11(3)4)17-12-6-8-13(9-7-12)20(5)14/h6-11H,1-5H3
InChIKey
ZAHCGJGQTLXHMW-UHFFFAOYSA-N
Compound name
(4-methylsulfinylphenoxy)-di(propan-2-yloxy)-sulfanylidene-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

336.0619 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.06918 170.5
[M+Na]+ 359.05112 178.4
[M+NH4]+ 354.09572 176.5
[M+K]+ 375.02506 171.8
[M-H]- 335.05462 169.8
[M+Na-2H]- 357.03657 172.8
[M]+ 336.06135 172.1
[M]- 336.06245 172.1
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.