| SpectraBase Compound ID | FsprA18apg3 |
|---|---|
| InChI | InChI=1S/C14H12O3S/c1-10(15)17-14(11-6-3-2-4-7-11)13(16)12-8-5-9-18-12/h2-9,14H,1H3/t14-/m0/s1 |
| InChIKey | XAZVDAWYBULNTB-AWEZNQCLSA-N |
| Mol Weight | 260.31 g/mol |
| Molecular Formula | C14H12O3S |
| Exact Mass | 260.050715 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DANJwljuUJb |
|---|---|
| Name | (S)-1-(2-Thienyl)-2-acetoxy-2-phenylethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.050715417 u |
| Formula | C14H12O3S |
| InChI | InChI=1S/C14H12O3S/c1-10(15)17-14(11-6-3-2-4-7-11)13(16)12-8-5-9-18-12/h2-9,14H,1H3/t14-/m0/s1 |
| InChIKey | XAZVDAWYBULNTB-AWEZNQCLSA-N |
| Molecular Weight | 260.307 g/mol |
| SMILES | C([C@@](OC(=O)C)(C=1C=CC=CC1)[H])(C=1SC=CC1)=O |