| SpectraBase Compound ID | JIQW6w5c1Jd |
|---|---|
| InChI | InChI=1S/C31H43NO4/c1-5-21-13-16-25-24(21)15-14-23(28(25)29(33)26-11-8-18-32-26)10-7-9-22(6-2)30-19(3)12-17-27(36-30)20(4)31(34)35/h7-11,14-15,18-21,23-25,27-28,30,32H,5-6,12-13,16-17H2,1-4H3,(H,34,35)/b10-7+,22-9+ |
| InChIKey | BAIPOTOKPGDCHA-MDHUWUIGSA-N |
| Mol Weight | 493.7 g/mol |
| Molecular Formula | C31H43NO4 |
| Exact Mass | 493.319209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KoZhNfMBvIt |
|---|---|
| Name | X.14547-A |
| CAS Registry Number | 66513-28-8 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C31H43NO4 |
| InChI | InChI=1S/C31H43NO4/c1-5-21-13-16-25-24(21)15-14-23(28(25)29(33)26-11-8-18-32-26)10-7-9-22(6-2)30-19(3)12-17-27(36-30)20(4)31(34)35/h7-11,14-15,18-21,23-25,27-28,30,32H,5-6,12-13,16-17H2,1-4H3,(H,34,35)/b10-7+,22-9+ |
| InChIKey | BAIPOTOKPGDCHA-MDHUWUIGSA-N |
| Literature Reference | J. Org. Chem. 49, 1797 (1984). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |