| SpectraBase Compound ID | 6DMHVei7nNk |
|---|---|
| InChI | InChI=1S/C64H46F5NO14/c65-49-50(66)52(68)55(53(69)51(49)67)82-62(75)47(70-64(76)78-34-46-44-27-15-13-25-42(44)43-26-14-16-28-45(43)46)33-36-29-31-41(32-30-36)79-63-57(84-61(74)40-23-11-4-12-24-40)56(83-60(73)39-21-9-3-10-22-39)54(81-59(72)38-19-7-2-8-20-38)48(80-63)35-77-58(71)37-17-5-1-6-18-37/h1-32,46-48,54,56-57,63H,33-35H2,(H,70,76)/t47-,48-,54-,56+,57-,63+/m0/s1 |
| InChIKey | CQUYVXGVABKOBJ-RNUIIZCHSA-N |
| Mol Weight | 1148.1 g/mol |
| Molecular Formula | C64H46F5NO14 |
| Exact Mass | 1147.283846 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7rcOGbcVM9p |
|---|---|
| Name | CQUYVXGVABKOBJ-RNUIIZCHSA-N |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C64H46F5NO14 |
| InChI | InChI=1S/C64H46F5NO14/c65-49-50(66)52(68)55(53(69)51(49)67)82-62(75)47(70-64(76)78-34-46-44-27-15-13-25-42(44)43-26-14-16-28-45(43)46)33-36-29-31-41(32-30-36)79-63-57(84-61(74)40-23-11-4-12-24-40)56(83-60(73)39-21-9-3-10-22-39)54(81-59(72)38-19-7-2-8-20-38)48(80-63)35-77-58(71)37-17-5-1-6-18-37/h1-32,46-48,54,56-57,63H,33-35H2,(H,70,76)/t47-,48-,54-,56+,57-,63+/m0/s1 |
| InChIKey | CQUYVXGVABKOBJ-RNUIIZCHSA-N |
| Literature Reference Author | K.J.JENSEN,M.MELDAL,K.BOCK |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,2119(1993) |
| Literature Reference DOI | 10.1039/p19930002119 |
| Molecular Weight | 1148.060 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWRU3385 |