| SpectraBase Compound ID | 16KRFAQv8f |
|---|---|
| InChI | InChI=1S/C25H28O3/c1-25-14-13-20-19-10-8-18(28-24(27)16-5-3-2-4-6-16)15-17(19)7-9-21(20)22(25)11-12-23(25)26/h2-6,8,10,15,20-23,26H,7,9,11-14H2,1H3/t20-,21-,22+,23+,25+/m1/s1 |
| InChIKey | UYIFTLBWAOGQBI-BZDYCCQFSA-N |
| Mol Weight | 376.5 g/mol |
| Molecular Formula | C25H28O3 |
| Exact Mass | 376.203845 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 69my1CwkGQ4 |
|---|---|
| Name | 17β-Estradiol 3-benzoate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H28O3 |
| InChI | InChI=1S/C25H28O3/c1-25-14-13-20-19-10-8-18(28-24(27)16-5-3-2-4-6-16)15-17(19)7-9-21(20)22(25)11-12-23(25)26/h2-6,8,10,15,20-23,26H,7,9,11-14H2,1H3/t20-,21-,22+,23+,25+/m1/s1 |
| InChIKey | UYIFTLBWAOGQBI-BZDYCCQFSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 36302M |
| Solvent | CDCl3 |