| SpectraBase Compound ID | 6bGAVe4HPpW |
|---|---|
| InChI | InChI=1S/C57H92O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h7-12,16-21,25-30,54H,4-6,13-15,22-24,31-53H2,1-3H3/b10-7+,11-8+,12-9+,19-16+,20-17+,21-18+,28-25+,29-26+,30-27+ |
| InChIKey | UBEIMDKGOYBUKT-IQDUZEPSSA-N |
| Mol Weight | 873.4 g/mol |
| Molecular Formula | C57H92O6 |
| Exact Mass | 872.689391 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8yHVxVXuY0V |
|---|---|
| Name | TRILINOLENIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C57H92O6 |
| InChI | InChI=1S/C57H92O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h7-12,16-21,25-30,54H,4-6,13-15,22-24,31-53H2,1-3H3/b10-7+,11-8+,12-9+,19-16+,20-17+,21-18+,28-25+,29-26+,30-27+ |
| InChIKey | UBEIMDKGOYBUKT-IQDUZEPSSA-N |
| Literature Reference Author | L.MANNINA,C.LUCHINAT,M.PATUMI,M.C.EMANUELE,E.ROSSI,A.SEGRE |
| Literature Reference Citation | MAGN.RES.CHEM.,38,886(2000) |
| Literature Reference DOI | 10.1002/1097-458x(200010)38:10<886::aid-mrc738>3.0.co;2-j |
| Molecular Weight | 873.354 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI3528 |