CID 3047934

Monsanto cp-10739

Structural Information

Molecular Formula
C8H21O9P3S
SMILES
COP(=C(P(=O)(OC)OC)SP(=O)(OC)OC)(OC)OC
InChI
InChI=1S/C8H21O9P3S/c1-11-18(9,12-2)8(19(13-3,14-4)15-5)21-20(10,16-6)17-7/h1-7H3
InChIKey
XFQPBFXIWDCVET-UHFFFAOYSA-N
Compound name
[dimethoxyphosphoryl(dimethoxyphosphorylsulfanyl)methylidene]-trimethoxy-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

386.0119 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 387.01918 197.1
[M+Na]+ 409.00112 199.2
[M-H]- 385.00462 195.4
[M+NH4]+ 404.04572 206.3
[M+K]+ 424.97506 191.2
[M+H-H2O]+ 369.00916 175.4
[M+HCOO]- 431.01010 217.9
[M+CH3COO]- 445.02575 215.4
[M+Na-2H]- 406.98657 182.3
[M]+ 386.01135 199.4
[M]- 386.01245 199.4
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.