| SpectraBase Compound ID | C2C4BQSS1jg |
|---|---|
| InChI | InChI=1S/C22H31F3O4/c1-12(26)28-14-4-5-18-15-8-9-20(3)17(6-7-19(20)29-13(2)27)16(15)11-22(24,25)21(18,23)10-14/h14-19H,4-11H2,1-3H3/t14-,15?,16?,17?,18?,19-,20?,21-/m0/s1 |
| InChIKey | GHNUGLZEGIXOPM-QRMCVIMVSA-N |
| Mol Weight | 416.48 g/mol |
| Molecular Formula | C22H31F3O4 |
| Exact Mass | 416.217444 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3FExIwseAjE |
|---|---|
| Name | GHNUGLZEGIXOPM-QRMCVIMVSA-N |
| Compound Number | 1B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H31F3O4 |
| InChI | InChI=1S/C22H31F3O4/c1-12(26)28-14-4-5-18-15-8-9-20(3)17(6-7-19(20)29-13(2)27)16(15)11-22(24,25)21(18,23)10-14/h14-19H,4-11H2,1-3H3/t14-,15?,16?,17?,18?,19-,20?,21-/m0/s1 |
| InChIKey | GHNUGLZEGIXOPM-QRMCVIMVSA-N |
| Literature Reference Author | J.T.NELSON,L.J.KURZ |
| Literature Reference Citation | MAGN.RES.CHEM.,31,203(1993) |
| Literature Reference DOI | 10.1002/mrc.1260310210 |
| Solvent | CDCl3 |
| Source File Reference | UWVP4926 |