![2-{[(2-acetyl-5-tert-butyl-3-thienyl)amino]methylene}-4,4,4-trifluoroacetoacetic acid, ethyl ester](/api/spectrum/IbE9EPeJokb/structure.png?h=300&w=458 "2-{[(2-acetyl-5-tert-butyl-3-thienyl)amino]methylene}-4,4,4-trifluoroacetoacetic acid, ethyl ester")
| SpectraBase Compound ID | JKC1HMBVIa |
|---|---|
| InChI | InChI=1S/C17H20F3NO4S/c1-6-25-15(24)10(14(23)17(18,19)20)8-21-11-7-12(16(3,4)5)26-13(11)9(2)22/h7-8,21H,6H2,1-5H3 |
| InChIKey | SQRRGJJUDPOZFJ-UHFFFAOYSA-N |
| Mol Weight | 391.41 g/mol |
| Molecular Formula | C17H20F3NO4S |
| Exact Mass | 391.106514 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IbE9EPeJokb |
|---|---|
| Name | 2-{[(2-acetyl-5-tert-butyl-3-thienyl)amino]methylene}-4,4,4-trifluoroacetoacetic acid, ethyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H20F3NO4S |
| InChI | InChI=1S/C17H20F3NO4S/c1-6-25-15(24)10(14(23)17(18,19)20)8-21-11-7-12(16(3,4)5)26-13(11)9(2)22/h7-8,21H,6H2,1-5H3 |
| InChIKey | SQRRGJJUDPOZFJ-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 61011M |
| Solvent | CDCl3 |