CID 70550

1018-28-6

Structural Information

Molecular Formula
C9H19O2PS4
SMILES
CCOP(=S)(OCC)SCC1(SCCS1)C
InChI
InChI=1S/C9H19O2PS4/c1-4-10-12(13,11-5-2)16-8-9(3)14-6-7-15-9/h4-8H2,1-3H3
InChIKey
PBYOJMHVUCJVNU-UHFFFAOYSA-N
Compound name
diethoxy-[(2-methyl-1,3-dithiolan-2-yl)methylsulfanyl]-sulfanylidene-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.00055 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.00783 157.2
[M+Na]+ 340.98977 162.1
[M+NH4]+ 336.03437 166.2
[M+K]+ 356.96371 151.7
[M-H]- 316.99327 157.4
[M+Na-2H]- 338.97522 158.7
[M]+ 318.00000 159.6
[M]- 318.00110 159.6
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.