CID 518483

Tetraphosphorus heptasulphide

Structural Information

Molecular Formula
P4S7
SMILES
P12SP3SP(S1)SP(=S)(S2)S3
InChI
InChI=1S/P4S7/c5-4-9-1-6-2(10-4)8-3(7-1)11-4
InChIKey
LUGHFUPPCAAIHD-UHFFFAOYSA-N
Compound name
1-sulfanylidene-2,4,6,8,9,10-hexathia-1lambda5,3,5,7-tetraphosphatricyclo[3.3.1.13,7]decane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

76
Patents

347.69955 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.70683 107.0
[M+Na]+ 370.68877 110.4
[M+NH4]+ 365.73337 117.1
[M+K]+ 386.66271 101.4
[M-H]- 346.69227 105.7
[M+Na-2H]- 368.67422 107.6
[M]+ 347.69900 109.1
[M]- 347.70010 109.1
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

patents stripe