1,7-ALPHA-DIBROMODIHYDROTHEBAINONE-HYDROBROMIDE
Compound with spectra: 1 NMR
| SpectraBase Compound ID | 3QFbOe0WEMp |
|---|---|
| InChI | InChI=1S/C18H21Br2NO3.BrH/c1-21-4-3-18-8-14(22)12(20)6-10(18)13(21)5-9-11(19)7-15(24-2)17(23)16(9)18;/h7,10,12-13,23H,3-6,8H2,1-2H3;1H/t10?,12-,13+,18-;/m0./s1 |
| InChIKey | XAKFSFLICCWHNB-RAGGRQTGSA-N |
| Mol Weight | 540.09 g/mol |
| Molecular Formula | C18H22Br3NO3 |
| Exact Mass | 536.914983 g/mol |
| Parent InChIKey | CWQLJTAUACYSKW-WQUACPNESA-N |
| Enantiomer InChIKey | XAKFSFLICCWHNB-QRQRCOGKSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CD3COOH |
| Title | Journal or Book | Year |
|---|---|---|
| On the closure of the 4,5-oxygen bridge in morphinans 1H and 13C NMR spectroscopy of brominated intermediates. (Chemistry of opium alkaloids, Part IX) | Recueil des Travaux Chimiques des Pays-Bas | 2010 |
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.