| SpectraBase Compound ID | 2C5nB1SwzCo |
|---|---|
| InChI | InChI=1S/C23H26N2O4.C2HF3O2/c1-27-16-8-14-15(9-17(16)28-2)25-20(26)10-18-21-13-7-19-23(14,22(21)25)4-5-24(19)11-12(13)3-6-29-18;3-2(4,5)1(6)7/h3,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3;(H,6,7)/t13-,18-,19-,21-,22-,23?;/m0./s1 |
| InChIKey | ZEYJGIFEJXDJOK-WUOFDZCFSA-N |
| Mol Weight | 508.49 g/mol |
| Molecular Formula | C25H27F3N2O6 |
| Exact Mass | 508.182121 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4VZiCp9JGQ7 |
|---|---|
| Name | BRUCINE-TRIFLUOROACETATE |
| Compound Number | 4A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H27F3N2O6 |
| InChI | InChI=1S/C23H26N2O4.C2HF3O2/c1-27-16-8-14-15(9-17(16)28-2)25-20(26)10-18-21-13-7-19-23(14,22(21)25)4-5-24(19)11-12(13)3-6-29-18;3-2(4,5)1(6)7/h3,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3;(H,6,7)/t13-,18-,19-,21-,22-,23?;/m0./s1 |
| InChIKey | ZEYJGIFEJXDJOK-WUOFDZCFSA-N |
| Literature Reference Author | P.R.SRINIVASAN,R.L.LICHTER |
| Literature Reference Citation | ORG.MAGN.RES.,8,198(1976) |
| Literature Reference DOI | 10.1002/mrc.1270080408 |
| Molecular Weight | 508.494 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS8959 |