![AC2POII2PSII[C3H7,CH3,PH]](/api/spectrum/Ir5cqL6UhN4/structure.png?h=300&w=458 "AC2POII2PSII[C3H7,CH3,PH]")
| SpectraBase Compound ID | ANTINCXtIgv |
|---|---|
| InChI | InChI=1S/C68H68O10P4S2/c1-9-25-49-53-37-57-51(27-11-3)59-39-55-50(26-10-2)56-40-60-52(28-12-4)58-38-54(49)62-42(6)66(58)76-82(84,48-35-23-16-24-36-48)78-68(60)44(8)64(56)74-80(70,46-31-19-14-20-32-46)73-63(55)43(7)67(59)77-81(83,47-33-21-15-22-34-47)75-65(57)41(5)61(53)71-79(69,72-62)45-29-17-13-18-30-45/h13-24,29-40,49-52H,9-12,25-28H2,1-8H3/t49-,50+,51+,52-,79?,80?,81?,82? |
| InChIKey | WULPXOSDTSAAOF-IJYPKUEQSA-N |
| Mol Weight | 1233.3 g/mol |
| Molecular Formula | C68H68O10P4S2 |
| Exact Mass | 1232.320439 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ir5cqL6UhN4 |
|---|---|
| Name | AC2POII2PSII[C3H7,CH3,PH] |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C68H68O10P4S2 |
| InChI | InChI=1S/C68H68O10P4S2/c1-9-25-49-53-37-57-51(27-11-3)59-39-55-50(26-10-2)56-40-60-52(28-12-4)58-38-54(49)62-42(6)66(58)76-82(84,48-35-23-16-24-36-48)78-68(60)44(8)64(56)74-80(70,46-31-19-14-20-32-46)73-63(55)43(7)67(59)77-81(83,47-33-21-15-22-34-47)75-65(57)41(5)61(53)71-79(69,72-62)45-29-17-13-18-30-45/h13-24,29-40,49-52H,9-12,25-28H2,1-8H3/t49-,50+,51+,52-,79?,80?,81?,82? |
| InChIKey | WULPXOSDTSAAOF-IJYPKUEQSA-N |
| Literature Reference Author | D.MENOZZI,R.PINALLI,C.MASSERA,F.MAFFEI,E.DALCANALE |
| Literature Reference Citation | MOLECULES,20,4460(2015) |
| Literature Reference DOI | 10.3390/molecules20034460 |
| Solvent | CDCl3 |
| Source File Reference | UWPA3254 |