| SpectraBase Compound ID | HGmljpASTbD |
|---|---|
| InChI | InChI=1S/C17H21F3N2O6/c1-16(2,3)28-14(23)13(21-15(24)17(18,19)20)11(9-22(25)26)10-7-5-6-8-12(10)27-4/h5-8,11,13H,9H2,1-4H3,(H,21,24)/t11-,13+/m1/s1 |
| InChIKey | IZEJSRQARZQKRP-YPMHNXCESA-N |
| Mol Weight | 406.36 g/mol |
| Molecular Formula | C17H21F3N2O6 |
| Exact Mass | 406.135171 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8a4W0qo9arf |
|---|---|
| Name | SYN-2-(TRIFLUORACETYL)-AMINO-3-(2-METHYOXYPHENYL)-4-NITROBUTYRIC-ACID-TERT.-BUTYLESTER |
| Compound Number | 3E |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H21F3N2O6 |
| InChI | InChI=1S/C17H21F3N2O6/c1-16(2,3)28-14(23)13(21-15(24)17(18,19)20)11(9-22(25)26)10-7-5-6-8-12(10)27-4/h5-8,11,13H,9H2,1-4H3,(H,21,24)/t11-,13+/m1/s1 |
| InChIKey | IZEJSRQARZQKRP-YPMHNXCESA-N |
| Literature Reference Author | B.MENDLER,U.KAZMAIER |
| Literature Reference Citation | ORG.LETTERS,7,1715(2005) |
| Literature Reference DOI | 10.1021/ol050129j |
| Molecular Weight | 406.359 g/mol |
| Sample ID | 62118 |
| Solvent | Unknown |