| SpectraBase Compound ID | Bena5Dpz0WN |
|---|---|
| InChI | InChI=1S/C21H30O4/c1-13-9-11-21-12-16(13)20(3,10-5-6-14(2)19(24)25-4)17(21)8-7-15(21)18(22)23/h6,9,15-17H,5,7-8,10-12H2,1-4H3,(H,22,23)/b14-6+/t15-,16?,17+,20+,21+/m1/s1 |
| InChIKey | NJJHWXTWQAGIRM-SMFYIDNOSA-N |
| Mol Weight | 346.47 g/mol |
| Molecular Formula | C21H30O4 |
| Exact Mass | 346.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KysZb4t3TBU |
|---|---|
| Name | NJJHWXTWQAGIRM-SMFYIDNOSA-N |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H30O4 |
| InChI | InChI=1S/C21H30O4/c1-13-9-11-21-12-16(13)20(3,10-5-6-14(2)19(24)25-4)17(21)8-7-15(21)18(22)23/h6,9,15-17H,5,7-8,10-12H2,1-4H3,(H,22,23)/b14-6+/t15-,16?,17+,20+,21+/m1/s1 |
| InChIKey | NJJHWXTWQAGIRM-SMFYIDNOSA-N |
| Literature Reference Author | P.G.FORSTER,E.L.GHISALBERTI,P.R.JEFFERIES |
| Literature Reference Citation | J.NAT.PROD.,56,147(1993) |
| Literature Reference DOI | 10.1021/np50091a024 |
| Molecular Weight | 346.467 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS1031 |