| SpectraBase Compound ID | Wq1QykqNlS |
|---|---|
| InChI | InChI=1S/C19H23BrO2/c1-19-8-7-14-13-6-4-12(22-2)9-11(13)3-5-15(14)16(19)10-17(20)18(19)21/h4,6,9,14-17H,3,5,7-8,10H2,1-2H3/t14-,15-,16+,17-,19+/m1/s1 |
| InChIKey | CSELWEPNDJXTQB-ILYVXUQDSA-N |
| Mol Weight | 363.3 g/mol |
| Molecular Formula | C19H23BrO2 |
| Exact Mass | 362.088143 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AMLlQhMql5i |
|---|---|
| Name | 16-ALPHA-BROMO-3-METHOXYESTRA-1,3,5(10)-TRIEN-17-ON |
| Compound Number | 384 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C19H23BrO2 |
| InChI | InChI=1S/C19H23BrO2/c1-19-8-7-14-13-6-4-12(22-2)9-11(13)3-5-15(14)16(19)10-17(20)18(19)21/h4,6,9,14-17H,3,5,7-8,10H2,1-2H3/t14-,15-,16+,17-,19+/m1/s1 |
| InChIKey | CSELWEPNDJXTQB-ILYVXUQDSA-N |
| Literature Reference Author | J.W.BLUNT,J.B.STOTHERS |
| Literature Reference Citation | ORG.MAGN.RES.,9,439(1977) |
| Literature Reference DOI | 10.1002/mrc.1270090802 |
| Molecular Weight | 363.294 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW4072 |