CID 76871

3347-30-6

Structural Information

Molecular Formula
C6H15OPS3
SMILES
CCOP(=S)(SCC)SCC
InChI
InChI=1S/C6H15OPS3/c1-4-7-8(9,10-5-2)11-6-3/h4-6H2,1-3H3
InChIKey
SJQKMVSYJWSDSI-UHFFFAOYSA-N
Compound name
ethoxy-bis(ethylsulfanyl)-sulfanylidene-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

230.00226 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.00954 142.4
[M+Na]+ 252.99148 148.8
[M-H]- 228.99498 140.7
[M+NH4]+ 248.03608 161.1
[M+K]+ 268.96542 143.9
[M+H-H2O]+ 212.99952 134.0
[M+HCOO]- 275.00046 153.5
[M+CH3COO]- 289.01611 190.1
[M+Na-2H]- 250.97693 139.5
[M]+ 230.00171 146.1
[M]- 230.00281 146.1
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