| SpectraBase Compound ID | 9g56Af6LJ5j |
|---|---|
| InChI | InChI=1S/C23H30ClNO3/c1-14(26)16-12-22-9-6-17-20(2,7-5-8-21(17,3)19(27)28-4)18(22)10-15(16)11-23(22,24)13-25/h12,15,17-18H,5-11H2,1-4H3/t15-,17-,18-,20+,21-,22+,23+/m1/s1 |
| InChIKey | RPYXWNVBEJOOQR-HSIVQJEESA-N |
| Mol Weight | 403.95 g/mol |
| Molecular Formula | C23H30ClNO3 |
| Exact Mass | 403.191422 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J2WSbSfqrAe |
|---|---|
| Name | METHYL-(4-ALPHA,15-BETA)-13-ACETYL-15-CHLORO-15-CYANO-17,19-DINORATIS-13-EN-4-CARBOXYLATE |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H30ClNO3 |
| InChI | InChI=1S/C23H30ClNO3/c1-14(26)16-12-22-9-6-17-20(2,7-5-8-21(17,3)19(27)28-4)18(22)10-15(16)11-23(22,24)13-25/h12,15,17-18H,5-11H2,1-4H3/t15-,17-,18-,20+,21-,22+,23+/m1/s1 |
| InChIKey | RPYXWNVBEJOOQR-HSIVQJEESA-N |
| Literature Reference Author | D.HOFNER,E.HASLINGER |
| Literature Reference Citation | MH.CHEM.,129,393(1998) |
| Literature Reference DOI | 10.1007/s007060050059 |
| Molecular Weight | 403.949 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU2722 |