CID 217157

38188-83-9

Structural Information

Molecular Formula
C8H17O3PS3
SMILES
CCOP(=S)(OCC)SC1COCCS1
InChI
InChI=1S/C8H17O3PS3/c1-3-10-12(13,11-4-2)15-8-7-9-5-6-14-8/h8H,3-7H2,1-2H3
InChIKey
DSSLOYDITKYOCI-UHFFFAOYSA-N
Compound name
diethoxy-(1,4-oxathian-3-ylsulfanyl)-sulfanylidene-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.00775 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.01503 155.3
[M+Na]+ 310.99697 159.4
[M-H]- 287.00047 156.2
[M+NH4]+ 306.04157 170.1
[M+K]+ 326.97091 156.2
[M+H-H2O]+ 271.00501 146.6
[M+HCOO]- 333.00595 164.3
[M+CH3COO]- 347.02160 196.0
[M+Na-2H]- 308.98242 153.8
[M]+ 288.00720 156.5
[M]- 288.00830 156.5
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.