CID 139256

Tetraphosphorus pentasulfide

Structural Information

Molecular Formula
P4S5
SMILES
P12P3SP(S1)SP(S2)S3
InChI
InChI=1S/P4S5/c5-1-2-7-3(5)9-4(6-1)8-2
InChIKey
LOZDOQJARMKMFN-UHFFFAOYSA-N
Compound name
2,4,6,8,9-pentathia-1,3,5,7-tetraphosphatricyclo[3.3.1.03,7]nonane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

59
Patents

283.7554 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.76268 120.7
[M+Na]+ 306.74462 129.3
[M-H]- 282.74812 114.5
[M+NH4]+ 301.78922 144.0
[M+K]+ 322.71856 127.7
[M+H-H2O]+ 266.75266 111.0
[M+HCOO]- 328.75360 139.4
[M+CH3COO]- 342.76925 131.0
[M+Na-2H]- 304.73007 125.4
[M]+ 283.75485 123.0
[M]- 283.75595 123.0
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