| SpectraBase Compound ID | 67567qNbRy7 |
|---|---|
| InChI | InChI=1S/C13H10FNO3S/c1-18-13(17)11-10(6-7-19-11)15-12(16)8-4-2-3-5-9(8)14/h2-7H,1H3,(H,15,16) |
| InChIKey | HDUAAFYMMMHQCX-UHFFFAOYSA-N |
| Mol Weight | 279.29 g/mol |
| Molecular Formula | C13H10FNO3S |
| Exact Mass | 279.036543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2CYkQgmXsSy |
|---|---|
| Name | Methyl 3-((2-fluorobenzoyl)amino)-2-thiophenecarboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.036542520 u |
| Formula | C13H10FNO3S |
| InChI | InChI=1S/C13H10FNO3S/c1-18-13(17)11-10(6-7-19-11)15-12(16)8-4-2-3-5-9(8)14/h2-7H,1H3,(H,15,16) |
| InChIKey | HDUAAFYMMMHQCX-UHFFFAOYSA-N |
| Molecular Weight | 279.285 g/mol |
| SMILES | C1(=C(NC(C2=C(F)C=CC=C2)=O)C=CS1)C(=O)OC |