| SpectraBase Compound ID | L2FOrLkBDTG |
|---|---|
| InChI | InChI=1S/C42H36O24P6S6/c43-67(44,45)61-25-1-13-31(14-2-25)73-37-38(74-32-15-3-26(4-16-32)62-68(46,47)48)40(76-34-19-7-28(8-20-34)64-70(52,53)54)42(78-36-23-11-30(12-24-36)66-72(58,59)60)41(77-35-21-9-29(10-22-35)65-71(55,56)57)39(37)75-33-17-5-27(6-18-33)63-69(49,50)51/h1-24H,(H2,43,44,45)(H2,46,47,48)(H2,49,50,51)(H2,52,53,54)(H2,55,56,57)(H2,58,59,60) |
| InChIKey | XOWZUAIONGQGBN-UHFFFAOYSA-N |
| Mol Weight | 1302.9 g/mol |
| Molecular Formula | C42H36O24P6S6 |
| Exact Mass | 1301.834651 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3CwzFp1vkoA |
|---|---|
| Name | PPS-1-OPO3H2 |
| Compound Number | A-1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H24O24P6S6 |
| InChI | InChI=1S/C42H36O24P6S6/c43-67(44,45)61-25-1-13-31(14-2-25)73-37-38(74-32-15-3-26(4-16-32)62-68(46,47)48)40(76-34-19-7-28(8-20-34)64-70(52,53)54)42(78-36-23-11-30(12-24-36)66-72(58,59)60)41(77-35-21-9-29(10-22-35)65-71(55,56)57)39(37)75-33-17-5-27(6-18-33)63-69(49,50)51/h1-24H,(H2,43,44,45)(H2,46,47,48)(H2,49,50,51)(H2,52,53,54)(H2,55,56,57)(H2,58,59,60) |
| InChIKey | XOWZUAIONGQGBN-UHFFFAOYSA-N |
| Literature Reference Author | F.M.MENGER,V.A.AZOV |
| Literature Reference Citation | J.AM.CHEM.SOC.,124,11159(2002) |
| Literature Reference DOI | 10.1021/ja0206238 |
| Solvent | DMSO-D6 |
| Source File Reference | UWSI34910 |