| SpectraBase Compound ID | GdfMzAEdoH6 |
|---|---|
| InChI | InChI=1S/C17H12O2S/c18-17(16-11-6-12-20-16)19-15-10-5-4-9-14(15)13-7-2-1-3-8-13/h1-12H |
| InChIKey | SIOCGDAZDMSEJK-UHFFFAOYSA-N |
| Mol Weight | 280.34 g/mol |
| Molecular Formula | C17H12O2S |
| Exact Mass | 280.055801 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5GM9NgaafN5 |
|---|---|
| Name | 2-Thiophenecarboxylic acid, 2-biphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.055800798 u |
| Formula | C17H12O2S |
| InChI | InChI=1S/C17H12O2S/c18-17(16-11-6-12-20-16)19-15-10-5-4-9-14(15)13-7-2-1-3-8-13/h1-12H |
| InChIKey | SIOCGDAZDMSEJK-UHFFFAOYSA-N |
| SMILES | C(C1=CC=CS1)(=O)OC1=C(C2=CC=CC=C2)C=CC=C1 |