| SpectraBase Compound ID | 2bLlxVHNHU2 |
|---|---|
| InChI | InChI=1S/C23H34O4/c1-14-15-6-7-17-22(4)10-5-9-21(2,3)16(22)8-11-23(17,13-15)20(14)27-19(26)12-18(24)25/h15-17,20H,1,5-13H2,2-4H3,(H,24,25)/t15-,16-,17+,20-,22-,23-/m1/s1 |
| InChIKey | QKYIBJIGAUGMKR-NEIWCESCSA-N |
| Mol Weight | 374.5 g/mol |
| Molecular Formula | C23H34O4 |
| Exact Mass | 374.24571 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1NjZFC59GOF |
|---|---|
| Name | ENT-KAUR-16-EN-15-BETA-YL-HYDROGEN-MALONATE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H34O4 |
| InChI | InChI=1S/C23H34O4/c1-14-15-6-7-17-22(4)10-5-9-21(2,3)16(22)8-11-23(17,13-15)20(14)27-19(26)12-18(24)25/h15-17,20H,1,5-13H2,2-4H3,(H,24,25)/t15-,16-,17+,20-,22-,23-/m1/s1 |
| InChIKey | QKYIBJIGAUGMKR-NEIWCESCSA-N |
| Literature Reference Author | U.LANGENBAHN,G.BURKHARDT,H.BECKER |
| Literature Reference Citation | PHYTOCHEM.,33,1173(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85044-R |
| Molecular Weight | 374.521 g/mol |
| Solvent | CDCl3 |