| SpectraBase Compound ID | JheJ2c6jR4c |
|---|---|
| InChI | InChI=1S/C30H46O4/c1-21(2)10-8-12-25(29(33)34)13-9-11-22(3)14-17-26-18-16-24(5)27(30(26,6)7)19-15-23(4)20-28(31)32/h10,13-14,20,26-27H,5,8-9,11-12,15-19H2,1-4,6-7H3,(H,31,32)(H,33,34)/b22-14+,23-20+,25-13-/t26-,27+/m0/s1 |
| InChIKey | NMZFMIKOZHNSQU-WJSXGGOWSA-N |
| Mol Weight | 470.7 g/mol |
| Molecular Formula | C30H46O4 |
| Exact Mass | 470.33961 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9cye04whu59 |
|---|---|
| Name | MISPYRIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O4 |
| InChI | InChI=1S/C30H46O4/c1-21(2)10-8-12-25(29(33)34)13-9-11-22(3)14-17-26-18-16-24(5)27(30(26,6)7)19-15-23(4)20-28(31)32/h10,13-14,20,26-27H,5,8-9,11-12,15-19H2,1-4,6-7H3,(H,31,32)(H,33,34)/b22-14+,23-20+,25-13-/t26-,27+/m0/s1 |
| InChIKey | NMZFMIKOZHNSQU-WJSXGGOWSA-N |
| Literature Reference Author | D.A.SUN,J.Z.DENG,S.R.STARCK,S.M.HECHT |
| Literature Reference Citation | J.AM.CHEM.SOC.,121,6120(1999) |
| Literature Reference DOI | 10.1021/ja990208o |
| Molecular Weight | 470.693 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU11426 |