| SpectraBase Compound ID | DnEYVqXtNCT |
|---|---|
| InChI | InChI=1S/C21H36O2/c1-14-8-9-16-20(4)12-7-11-19(2,3)15(20)10-13-21(16,5)17(14)18(22)23-6/h14-17H,7-13H2,1-6H3/t14-,15+,16-,17+,20+,21-/m0/s1 |
| InChIKey | UIDMYMSEOUQQFT-OAYGGAORSA-N |
| Mol Weight | 320.5 g/mol |
| Molecular Formula | C21H36O2 |
| Exact Mass | 320.27153 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GREEln1tjPQ |
|---|---|
| Name | METHYLDIHYDROISOCOPALATE |
| CAS Registry Number | 72264-64-3 |
| Compound Number | 17 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H36O2 |
| InChI | InChI=1S/C21H36O2/c1-14-8-9-16-20(4)12-7-11-19(2,3)15(20)10-13-21(16,5)17(14)18(22)23-6/h14-17H,7-13H2,1-6H3/t14-,15+,16-,17+,20+,21-/m0/s1 |
| InChIKey | UIDMYMSEOUQQFT-OAYGGAORSA-N |
| Literature Reference Author | P.M.IMAMURA,E.A.RUVEDA |
| Literature Reference Citation | J.ORG.CHEM.,45,510(1980) |
| Literature Reference DOI | 10.1021/jo01291a028 |
| Molecular Weight | 320.516 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW17690 |