| SpectraBase Compound ID | JLryhBE2tDV |
|---|---|
| InChI | InChI=1S/C35H30FNO9/c1-40-28-12-20(13-29(41-2)33(28)46-35(39)43-16-19-6-4-3-5-7-19)30-23-14-26-27(45-18-44-26)15-24(23)32(25-17-42-34(38)31(25)30)37-22-10-8-21(36)9-11-22/h3-15,25,30-32,37H,16-18H2,1-2H3/t25-,30+,31-,32-/m0/s1 |
| InChIKey | HCKAOTQWBACMHO-AUSNPOTESA-N |
| Mol Weight | 627.6 g/mol |
| Molecular Formula | C35H30FNO9 |
| Exact Mass | 627.19046 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | El1DzXvjJ8d |
|---|---|
| Name | MINOR-ISOMER |
| Compound Number | 15E |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H30FNO9 |
| InChI | InChI=1S/C35H30FNO9/c1-40-28-12-20(13-29(41-2)33(28)46-35(39)43-16-19-6-4-3-5-7-19)30-23-14-26-27(45-18-44-26)15-24(23)32(25-17-42-34(38)31(25)30)37-22-10-8-21(36)9-11-22/h3-15,25,30-32,37H,16-18H2,1-2H3/t25-,30+,31-,32-/m0/s1 |
| InChIKey | HCKAOTQWBACMHO-AUSNPOTESA-N |
| Literature Reference Author | D.B.BERKOWITZ,S.CHOI,D.BHUNIYA,R.K.SHOEMAKER |
| Literature Reference Citation | ORG.LETTERS,2,1149(2000) |
| Literature Reference DOI | 10.1021/ol005732a |
| Solvent | CDCl3 |
| Source File Reference | UWLU33472 |