| SpectraBase Compound ID | 5Ysmv7pPDBs |
|---|---|
| InChI | InChI=1S/C18H24O3/c1-18-9-8-11-10-4-6-15(19)17(21)13(10)3-2-12(11)14(18)5-7-16(18)20/h4,6,11-12,14,16,19-21H,2-3,5,7-9H2,1H3/t11?,12?,14?,16-,18-/m0/s1 |
| InChIKey | QOZFCKXEVSGWGS-JNYWYMJGSA-N |
| Mol Weight | 288.39 g/mol |
| Molecular Formula | C18H24O3 |
| Exact Mass | 288.172545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5WN9SexIJxA |
|---|---|
| Name | 4-HYDROXYESTRADIOL |
| Compound Number | 5A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C18H24O3 |
| InChI | InChI=1S/C18H24O3/c1-18-9-8-11-10-4-6-15(19)17(21)13(10)3-2-12(11)14(18)5-7-16(18)20/h4,6,11-12,14,16,19-21H,2-3,5,7-9H2,1H3/t11?,12?,14?,16-,18-/m0/s1 |
| InChIKey | QOZFCKXEVSGWGS-JNYWYMJGSA-N |
| Literature Reference Author | H.MAJGIER-BARANOWSKA,J.N.BRIDSON,K.MARAT,J.F.TEMPLETON |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,1967(1998) |
| Literature Reference DOI | 10.1039/a709186i |
| Molecular Weight | 288.387 g/mol |
| Solvent | CD3OD:CDCl3 |