![Tri[1,3,5-tris(4,5-tetramethylene-2-thiapentyl)phenyl]phosphine 2-dioxide (in-cyclophane)](/api/spectrum/1rNO948gY5F/structure.png?h=300&w=458 "Tri[1,3,5-tris(4,5-tetramethylene-2-thiapentyl)phenyl]phosphine 2-dioxide (in-cyclophane)")
| SpectraBase Compound ID | E7rBtSQ0JvP |
|---|---|
| InChI | InChI=1S/C30H27O6PS3/c31-38(32)16-22-13-23-15-24(14-22)18-40(35,36)21-27-9-3-6-12-30(27)37(28-10-4-1-7-25(28)19-38)29-11-5-2-8-26(29)20-39(33,34)17-23/h1-15H,16-21H2 |
| InChIKey | NNDQFZHRRSFUTM-UHFFFAOYSA-N |
| Mol Weight | 610.69 g/mol |
| Molecular Formula | C30H27O6PS3 |
| Exact Mass | 610.070739 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 1rNO948gY5F |
|---|---|
| Name | Tri[1,3,5-tris(4,5-tetramethylene-2-thiapentyl)phenyl]phosphine 2-dioxide (in-cyclophane) |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H27O6PS3 |
| InChI | InChI=1S/C30H27O6PS3/c31-38(32)16-22-13-23-15-24(14-22)18-40(35,36)21-27-9-3-6-12-30(27)37(28-10-4-1-7-25(28)19-38)29-11-5-2-8-26(29)20-39(33,34)17-23/h1-15H,16-21H2 |
| InChIKey | NNDQFZHRRSFUTM-UHFFFAOYSA-N |
| Molecular Weight | 610.694 g/mol |
| SMILES | c12P3c4c(CS(Cc5cc(CS(Cc2cccc1)(=O)=O)cc(c5)CS(Cc1c3cccc1)(=O)=O)(=O)=O)cccc4 |
| SPLASH | splash10-014i-0000913000-1a7768f05c3f98acc316 |
| Source of Spectrum | J-64-5631-17 |
| Synonyms | 9,17,32-trithia-1-phosphahexacyclo[11.11.9.1(11,15).0(2,7).0(19,24).0(25,30)]tetratriaconta-2,4,6,11,13,15(34),19,21,23,25,27,29-dodecaene 9,9,17,17,32,32-hexaoxide Phosphaphane trisulfone[Tribenzo-6-phospha-2,10,19-trithia[10]metacyclophane-2,2,10,10,19,19-hexaoxide] |
| Wiley ID | 1530727 |