| SpectraBase Compound ID | DS8GkYOb3PH |
|---|---|
| InChI | InChI=1S/C29H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29(30)31/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-28H2,1H3,(H,30,31)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18- |
| InChIKey | YAOMQRJOBKYDFI-KUBAVDMBSA-N |
| Mol Weight | 426.7 g/mol |
| Molecular Formula | C29H46O2 |
| Exact Mass | 426.349781 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6j0IWTR4mc3 |
|---|---|
| Name | (ALL-Z)-NONACOSA-11,14,17,20,23,26-HEXAENOIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H46O2 |
| InChI | InChI=1S/C29H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29(30)31/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-28H2,1H3,(H,30,31)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18- |
| InChIKey | YAOMQRJOBKYDFI-KUBAVDMBSA-N |
| Literature Reference Author | T.REZANKA,L.NEDBALOVA,K.SIGLER |
| Literature Reference Citation | PHYTOCHEM.,69,2849(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.08.021 |
| Molecular Weight | 426.683 g/mol |
| Sample ID | 63802 |
| Solvent | CDCl3 |