| SpectraBase Compound ID | AFEo2dVzLBK |
|---|---|
| InChI | InChI=1S/C24H33F3N2OS/c1-5-12-21(22(24(25,26)27)28-31(30)23(2,3)4)29(17-19-13-8-6-9-14-19)18-20-15-10-7-11-16-20/h6-11,13-16,21-22,28H,5,12,17-18H2,1-4H3/t21-,22+,31?/m1/s1 |
| InChIKey | SMAOBCMHMAVEJO-GQHWJEKJSA-N |
| Mol Weight | 454.6 g/mol |
| Molecular Formula | C24H33F3N2OS |
| Exact Mass | 454.226569 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Bk6WCxroW8 |
|---|---|
| Name | SMAOBCMHMAVEJO-GQHWJEKJSA-N |
| Compound Number | 3B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H33F3N2OS |
| InChI | InChI=1S/C24H33F3N2OS/c1-5-12-21(22(24(25,26)27)28-31(30)23(2,3)4)29(17-19-13-8-6-9-14-19)18-20-15-10-7-11-16-20/h6-11,13-16,21-22,28H,5,12,17-18H2,1-4H3/t21-,22+,31?/m1/s1 |
| InChIKey | SMAOBCMHMAVEJO-GQHWJEKJSA-N |
| Literature Reference Author | G.K.S.PRAKASH,M.MANDAL |
| Literature Reference Citation | J.AM.CHEM.SOC.,124,6538(2002) |
| Literature Reference DOI | 10.1021/ja020482+ |
| Molecular Weight | 454.594 g/mol |
| Sample ID | 49997 |
| Solvent | CDCl3 |