| SpectraBase Compound ID | 36y3DmDc5Fy |
|---|---|
| InChI | InChI=1S/C30H37F3O6/c1-18-11-10-15-27(4)24(39-27)23(34)21-17-22(19(2)26(3,16-14-18)28(21,5)36)38-25(35)29(37-6,30(31,32)33)20-12-8-7-9-13-20/h7-9,11-13,17,19,22,24,36H,10,14-16H2,1-6H3/b18-11-/t19-,22+,24+,26+,27-,28+,29?/m0/s1 |
| InChIKey | JQUYEIWPNSAWMV-ILVIJNOASA-N |
| Mol Weight | 550.6 g/mol |
| Molecular Formula | C30H37F3O6 |
| Exact Mass | 550.254223 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7LrlnqNhbOO |
|---|---|
| Name | JQUYEIWPNSAWMV-ILVIJNOASA-N |
| Compound Number | 1E |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H37F3O6 |
| InChI | InChI=1S/C30H37F3O6/c1-18-11-10-15-27(4)24(39-27)23(34)21-17-22(19(2)26(3,16-14-18)28(21,5)36)38-25(35)29(37-6,30(31,32)33)20-12-8-7-9-13-20/h7-9,11-13,17,19,22,24,36H,10,14-16H2,1-6H3/b18-11-/t19-,22+,24+,26+,27-,28+,29?/m0/s1 |
| InChIKey | JQUYEIWPNSAWMV-ILVIJNOASA-N |
| Literature Reference Author | M.SUGANO,A.SATO,Y.IIJIMA,K.FURUYA,H.HARUYAMA,K.YODA,T.HATA |
| Literature Reference Citation | J.ORG.CHEM.,59,564(1994) |
| Literature Reference DOI | 10.1021/jo00082a012 |
| Molecular Weight | 550.615 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ2119 |