| SpectraBase Compound ID | 2rWnj8Uwxi5 |
|---|---|
| InChI | InChI=1S/C27H39NO3/c1-23(2)21-28-27(29)17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-24-18-19-25-26(20-24)31-22-30-25/h11,13-20,23H,3-10,12,21-22H2,1-2H3,(H,28,29)/b13-11+,16-14+,17-15+ |
| InChIKey | KXZKYCRWMZGOMF-CJPITNSQSA-N |
| Mol Weight | 425.6 g/mol |
| Molecular Formula | C27H39NO3 |
| Exact Mass | 425.292994 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5WDRlcth8GQ |
|---|---|
| Name | BRACHISTAMIDE-D |
| Compound Number | 132 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H39NO3 |
| InChI | InChI=1S/C27H39NO3/c1-23(2)21-28-27(29)17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-24-18-19-25-26(20-24)31-22-30-25/h11,13-20,23H,3-10,12,21-22H2,1-2H3,(H,28,29)/b13-11+,16-14+,17-15+ |
| InChIKey | KXZKYCRWMZGOMF-CJPITNSQSA-N |
| Literature Reference Author | J.C.D.NASCIMENTO,V.F.D.PAULA,J.M.DAVID,J.P.DAVID |
| Literature Reference Citation | QUIM.NOVA,35,2288(2012) |
| Literature Reference DOI | 10.1590/s0100-40422012001100037 |
| Molecular Weight | 425.612 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWIR12289 |