| SpectraBase Compound ID | 32AP0CsNwyu |
|---|---|
| InChI | InChI=1S/C15H12O4S/c16-14(10-6-7-10)18-11-3-1-4-12(9-11)19-15(17)13-5-2-8-20-13/h1-5,8-10H,6-7H2 |
| InChIKey | FIENKSZQJUQQRV-UHFFFAOYSA-N |
| Mol Weight | 288.32 g/mol |
| Molecular Formula | C15H12O4S |
| Exact Mass | 288.04563 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8XIPaBsxa3q |
|---|---|
| Name | 1,3-Benzenediol, o-cyclopropanecarbonyl-o'-(thiophene-2-carbonyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.045630036 u |
| Formula | C15H12O4S |
| InChI | InChI=1S/C15H12O4S/c16-14(10-6-7-10)18-11-3-1-4-12(9-11)19-15(17)13-5-2-8-20-13/h1-5,8-10H,6-7H2 |
| InChIKey | FIENKSZQJUQQRV-UHFFFAOYSA-N |
| SMILES | C1(=CC=CC(=C1)OC(=O)C=1SC=CC1)OC(=O)C1CC1 |