MAJOR-ROTAMER
Compound with spectra: 2 NMR
| SpectraBase Compound ID | 9Zf2EI1UUkb |
|---|---|
| InChI | InChI=1S/C50H47N5O9/c1-29(2)25-42-45(58)54-41-24-14-12-22-38(41)50(47(54)55(42)49(61)63-27-31-15-5-4-6-16-31)26-40(46(59)64-50)53-44(57)36-21-11-13-23-39(36)52-43(56)30(3)51-48(60)62-28-37-34-19-9-7-17-32(34)33-18-8-10-20-35(33)37/h4-24,29-30,37,40,42,47H,25-28H2,1-3H3,(H,51,60)(H,52,56)(H,53,57)/t30-,40+,42-,47-,50+/m0/s1 |
| InChIKey | ZWNMUAGMJFBLCD-JOWPHQSJSA-N |
| Mol Weight | 862.0 g/mol |
| Molecular Formula | C50H47N5O9 |
| Exact Mass | 861.337378 g/mol |
| Enantiomer InChIKey | ZWNMUAGMJFBLCD-MAGCBUHQSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
- MINOR-ROTAMER
| Title | Journal or Book | Year |
|---|---|---|
| Total Synthesis of (−)-Fumiquinazolines A, B, C, E, H, and I. Approaches to the Synthesis of Fiscalin A | The Journal of Organic Chemistry | 2002 |
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.