| SpectraBase Compound ID | 1TNXCpqVspx |
|---|---|
| InChI | InChI=1S/C21H28O2/c1-4-13-12-19(22)21(2)10-9-17-16-8-6-15(23-3)11-14(16)5-7-18(17)20(13)21/h6,8,11,13,17-18,20H,4-5,7,9-10,12H2,1-3H3/t13-,17-,18-,20+,21-/m1/s1 |
| InChIKey | GAZKSOIRITUGGG-PDGIXKCNSA-N |
| Mol Weight | 312.45 g/mol |
| Molecular Formula | C21H28O2 |
| Exact Mass | 312.20893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I44uIxVTj5x |
|---|---|
| Name | 15-BETA-ETHYL-3-METHOXY-ESTRA-1,3,5(10)-TRIEN-17-ONE |
| Compound Number | 2B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H28O2 |
| InChI | InChI=1S/C21H28O2/c1-4-13-12-19(22)21(2)10-9-17-16-8-6-15(23-3)11-14(16)5-7-18(17)20(13)21/h6,8,11,13,17-18,20H,4-5,7,9-10,12H2,1-3H3/t13-,17-,18-,20+,21-/m1/s1 |
| InChIKey | GAZKSOIRITUGGG-PDGIXKCNSA-N |
| Literature Reference Author | J.R.BULL,M.C.LOEDOLFF |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,1269(1996) |
| Literature Reference DOI | 10.1039/p19960001269 |
| Molecular Weight | 312.452 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS20677 |