| SpectraBase Compound ID | Fl4kzaSMeDv |
|---|---|
| InChI | InChI=1S/C16H17BrO4/c1-4-5-6-12-9(2)11-7-8-13(20-10(3)18)14(17)15(11)21-16(12)19/h7-8H,4-6H2,1-3H3 |
| InChIKey | KXGFOJBEYCRFMD-UHFFFAOYSA-N |
| Mol Weight | 353.21 g/mol |
| Molecular Formula | C16H17BrO4 |
| Exact Mass | 352.031022 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4ih8jjLo9Sz |
|---|---|
| Name | 8-bromo-3-butyl-7-hydroxy-4-methylcoumarin, acetate |
| Copyright | Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H17BrO4 |
| InChI | InChI=1S/C16H17BrO4/c1-4-5-6-12-9(2)11-7-8-13(20-10(3)18)14(17)15(11)21-16(12)19/h7-8H,4-6H2,1-3H3 |
| InChIKey | KXGFOJBEYCRFMD-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 52630M |
| Solvent | CDCl3 |