| SpectraBase Compound ID | 1lirTLhWm8H |
|---|---|
| InChI | InChI=1S/C52H76N10.2F6P/c1-11-15-19-43-45(21-17-13-3)61-33-49-54-50(58-57-49)34-62-36-60(44(20-16-12-2)46(62)22-18-14-4)32-40-24-38(26-42(28-40)52(8,9)10)30-48-53-47(55-56-48)29-37-23-39(31-59(43)35-61)27-41(25-37)51(5,6)7;2*1-7(2,3,4,5)6/h23-28,35-36H,11-22,29-34H2,1-10H3,(H,53,55,56)(H,54,57,58);;/q+2;2*-1 |
| InChIKey | IDUSQPYTXLVBJP-UHFFFAOYSA-N |
| Mol Weight | 1131.17836196 g/mol |
| Molecular Formula | C52H76F12N10P2 |
| Exact Mass | 1130.553804 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2dT3GHRCuyJ |
|---|---|
| Name | IDUSQPYTXLVBJP-UHFFFAOYSA-N |
| Compound Number | 5C.2PF6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H76F12N10P2 |
| InChI | InChI=1S/C52H76N10.2F6P/c1-11-15-19-43-45(21-17-13-3)61-33-49-54-50(58-57-49)34-62-36-60(44(20-16-12-2)46(62)22-18-14-4)32-40-24-38(26-42(28-40)52(8,9)10)30-48-53-47(55-56-48)29-37-23-39(31-59(43)35-61)27-41(25-37)51(5,6)7;2*1-7(2,3,4,5)6/h23-28,35-36H,11-22,29-34H2,1-10H3,(H,53,55,56)(H,54,57,58);;/q+2;2*-1 |
| InChIKey | IDUSQPYTXLVBJP-UHFFFAOYSA-N |
| Literature Reference Author | E.ALCALDE,C.AYALA,I.DINARES,N.MESQUIDA,F.SANCHEZ-FERRANDO |
| Literature Reference Citation | J.ORG.CHEM.,66,2281(2001) |
| Literature Reference DOI | 10.1021/jo005678b |
| Molecular Weight | 1131.171 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU26506 |