| SpectraBase Compound ID | JcqVHO6j0Gc |
|---|---|
| InChI | InChI=1S/C9H9F3N2O3S/c1-3-17-6(15)5-4(2)13-8(18-5)14-7(16)9(10,11)12/h3H2,1-2H3,(H,13,14,16) |
| InChIKey | PWGRJBWAENVFEG-UHFFFAOYSA-N |
| Mol Weight | 282.24 g/mol |
| Molecular Formula | C9H9F3N2O3S |
| Exact Mass | 282.028598 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CWSQ9GAwiBX |
|---|---|
| Name | Ethyl 2-amino-4-methylthiazole-5-carboxylate, N-trifluoroacetyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.028597818 u |
| Formula | C9H9F3N2O3S |
| InChI | InChI=1S/C9H9F3N2O3S/c1-3-17-6(15)5-4(2)13-8(18-5)14-7(16)9(10,11)12/h3H2,1-2H3,(H,13,14,16) |
| InChIKey | PWGRJBWAENVFEG-UHFFFAOYSA-N |
| Molecular Weight | 282.237 g/mol |
| SMILES | CC=1N=C(NC(C(F)(F)F)=O)SC1C(=O)OCC |