| SpectraBase Compound ID | IBBt9oIVIQX |
|---|---|
| InChI | InChI=1S/C17H11NO3S/c1-20-12-8-6-11(7-9-12)17-15(18-10-22)16(19)13-4-2-3-5-14(13)21-17/h2-9H,1H3 |
| InChIKey | GPQKYYWHAHZFSU-UHFFFAOYSA-N |
| Mol Weight | 309.34 g/mol |
| Molecular Formula | C17H11NO3S |
| Exact Mass | 309.045964 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5BgvsSeewGt |
|---|---|
| Name | isothiocyanic acid, 2-(p-methoxyphenyl)-4-oxo-4H-1-benzopyran-3-yl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H11NO3S |
| InChI | InChI=1S/C17H11NO3S/c1-20-12-8-6-11(7-9-12)17-15(18-10-22)16(19)13-4-2-3-5-14(13)21-17/h2-9H,1H3 |
| InChIKey | GPQKYYWHAHZFSU-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 41304M |
| Solvent | CDCl3 |