| SpectraBase Compound ID | KL0qaArhpBq |
|---|---|
| InChI | InChI=1S/C31H50O3/c1-20-21(32)9-10-22-28(20,4)12-11-23-29(22,5)16-18-31(7)24-19-27(3,25(33)34-8)14-13-26(24,2)15-17-30(23,31)6/h20,22-24H,9-19H2,1-8H3/t20?,22?,23?,24-,26-,27-,28?,29?,30+,31+/m0/s1 |
| InChIKey | HUCOFGZPMFYICY-CCEOLIGGSA-N |
| Mol Weight | 470.7 g/mol |
| Molecular Formula | C31H50O3 |
| Exact Mass | 470.375995 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2wq1T8aYnJI |
|---|---|
| Name | 3-Oxo-friedelan-20.alpha.-carboxymethylester |
| CAS Registry Number | 39903-11-2 |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C31H50O3 |
| InChI | InChI=1S/C31H50O3/c1-20-21(32)9-10-22-28(20,4)12-11-23-29(22,5)16-18-31(7)24-19-27(3,25(33)34-8)14-13-26(24,2)15-17-30(23,31)6/h20,22-24H,9-19H2,1-8H3/t20?,22?,23?,24-,26-,27-,28?,29?,30+,31+/m0/s1 |
| InChIKey | HUCOFGZPMFYICY-CCEOLIGGSA-N |
| Instrument Name | SF = 090 MHz |
| Literature Reference | Phytochem. 23, 2251 (1984). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |