| SpectraBase Compound ID | GApi6etytZt |
|---|---|
| InChI | InChI=1S/C18H13NO3S/c1-11-3-8-15-14(9-11)17(20)16(19-10-23)18(22-15)12-4-6-13(21-2)7-5-12/h3-9H,1-2H3 |
| InChIKey | KGHXBGPZRZPQJI-UHFFFAOYSA-N |
| Mol Weight | 323.37 g/mol |
| Molecular Formula | C18H13NO3S |
| Exact Mass | 323.061614 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5CJu5FMJ4Mr |
|---|---|
| Name | isothiocyanic acid, 2-(p-methoxyphenyl)-6-methyl-4-oxo-4H-1-benzopyran-3-yl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H13NO3S |
| InChI | InChI=1S/C18H13NO3S/c1-11-3-8-15-14(9-11)17(20)16(19-10-23)18(22-15)12-4-6-13(21-2)7-5-12/h3-9H,1-2H3 |
| InChIKey | KGHXBGPZRZPQJI-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 41303M |
| Solvent | CDCl3 |