| SpectraBase Compound ID | Fd3vWqK9twk |
|---|---|
| InChI | InChI=1S/C15H22F3N2O4P.Na/c1-2-3-7-10-19-25(22,23)13(15(16,17)18)20-14(21)24-11-12-8-5-4-6-9-12;/h4-6,8-9,13H,2-3,7,10-11H2,1H3,(H,20,21)(H2,19,22,23);/q;+1/p-1 |
| InChIKey | CWXCJHNBJYZTEK-UHFFFAOYSA-M |
| Mol Weight | 404.3 g/mol |
| Molecular Formula | C15H21F3N2NaO4P |
| Exact Mass | 404.108873 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J7uPeelJ9H2 |
|---|---|
| Name | CWXCJHNBJYZTEK-UHFFFAOYSA-M |
| Compound Number | 20 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C15H21F3N2NaO4P |
| InChI | InChI=1S/C15H22F3N2O4P.Na/c1-2-3-7-10-19-25(22,23)13(15(16,17)18)20-14(21)24-11-12-8-5-4-6-9-12;/h4-6,8-9,13H,2-3,7,10-11H2,1H3,(H,20,21)(H2,19,22,23);/q;+1/p-1 |
| InChIKey | CWXCJHNBJYZTEK-UHFFFAOYSA-M |
| Literature Reference Author | P.D.MEDINA,L.S.INGRASSIA,M.E.MULLIEZ |
| Literature Reference Citation | J.ORG.CHEM.,68,8424(2003) |
| Literature Reference DOI | 10.1021/jo034229j |
| Molecular Weight | 404.301 g/mol |
| Solvent | DMSO-D6:D2O |
| Source File Reference | UWVN21049 |