| SpectraBase Compound ID | 9DbWssfDTDv |
|---|---|
| InChI | InChI=1S/C24H42N4.2C2HF3O2/c1-3-5-7-9-11-13-19-15-21-23(17-25-19)28-22-16-20(26-18-24(22)27-21)14-12-10-8-6-4-2;2*3-2(4,5)1(6)7/h19-20,25-26H,3-18H2,1-2H3;2*(H,6,7)/t19-,20-;;/m1../s1 |
| InChIKey | QWNMKULCIZJKSP-WUMQWIPTSA-N |
| Mol Weight | 614.674 g/mol |
| Molecular Formula | C28H44F6N4O4 |
| Exact Mass | 614.326675 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BoAlcRReUOc |
|---|---|
| Name | (-)-BARRENAZINE-A.2TFA |
| Compound Number | 15A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H44F6N4O4 |
| InChI | InChI=1S/C24H42N4.2C2HF3O2/c1-3-5-7-9-11-13-19-15-21-23(17-25-19)28-22-16-20(26-18-24(22)27-21)14-12-10-8-6-4-2;2*3-2(4,5)1(6)7/h19-20,25-26H,3-18H2,1-2H3;2*(H,6,7)/t19-,20-;;/m1../s1 |
| InChIKey | QWNMKULCIZJKSP-WUMQWIPTSA-N |
| Literature Reference Author | T.FOCKEN,A.B.CHARETTE |
| Literature Reference Citation | ORG.LETTERS,8,2985(2006) |
| Literature Reference DOI | 10.1021/ol0609006 |
| Molecular Weight | 614.672 g/mol |
| Sample ID | 58153 |
| Solvent | CD3OD |