| SpectraBase Compound ID | 3ySdoLiH3sC |
|---|---|
| InChI | InChI=1S/C31H48O4/c1-26(2)14-16-31(25(34)35-7)17-15-29(5)20(21(31)18-26)8-9-23-27(3)12-11-24(33)28(4,19-32)22(27)10-13-30(23,29)6/h8,21-23,32H,9-19H2,1-7H3/t21-,22?,23?,27?,28?,29+,30?,31-/m1/s1 |
| InChIKey | SCNJKSGGJJIVNC-QNCULIBQSA-N |
| Mol Weight | 484.7 g/mol |
| Molecular Formula | C31H48O4 |
| Exact Mass | 484.35526 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DyRepZyeNEa |
|---|---|
| Name | Methyl-23-hydroxy-3-oxo-olean-12-en-28-oate |
| Comments | C/H - shift correlation |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C31H48O4 |
| InChI | InChI=1S/C31H48O4/c1-26(2)14-16-31(25(34)35-7)17-15-29(5)20(21(31)18-26)8-9-23-27(3)12-11-24(33)28(4,19-32)22(27)10-13-30(23,29)6/h8,21-23,32H,9-19H2,1-7H3/t21-,22?,23?,27?,28?,29+,30?,31-/m1/s1 |
| InChIKey | SCNJKSGGJJIVNC-QNCULIBQSA-N |
| Instrument Name | SF = 250 MHz |
| Literature Reference | Austr. J. Chem. 36, 2537 (1983). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |