| SpectraBase Compound ID | 4wr30WOrcfd |
|---|---|
| InChI | InChI=1S/C21H28O2/c1-3-10-21(23)12-9-19-18-6-4-14-13-15(22)5-7-16(14)17(18)8-11-20(19,21)2/h3,5,7,13,17-19,22-23H,1,4,6,8-12H2,2H3/t17-,18-,19+,20+,21+/m1/s1 |
| InChIKey | XEKBJRSLNPZRAN-MJCUULBUSA-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 | Gdl5lFhYgNS |
|---|---|
| Name | 17-ALPHA-ALLYL-ESTRADIOL |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H28O2 |
| InChI | InChI=1S/C21H28O2/c1-3-10-21(23)12-9-19-18-6-4-14-13-15(22)5-7-16(14)17(18)8-11-20(19,21)2/h3,5,7,13,17-19,22-23H,1,4,6,8-12H2,2H3/t17-,18-,19+,20+,21+/m1/s1 |
| InChIKey | XEKBJRSLNPZRAN-MJCUULBUSA-N |
| Literature Reference Author | P.DIONNE,D.POIRIER |
| Literature Reference Citation | STEROIDS,60,830(1995) |
| Literature Reference DOI | 10.1016/0039-128x(95)00147-i |
| Molecular Weight | 312.452 g/mol |
| Source File Reference | UWLU73950 |