| SpectraBase Compound ID | 5wuL694TPFP |
|---|---|
| InChI | InChI=1S/C20H26BrNO3.ClH/c1-3-4-8-14-13(2)15-11-17(21)18(23)16(19(15)25-20(14)24)12-22-9-6-5-7-10-22;/h11,23H,3-10,12H2,1-2H3;1H |
| InChIKey | OBJFIEDXIQZNNQ-UHFFFAOYSA-N |
| Mol Weight | 444.8 g/mol |
| Molecular Formula | C20H27BrClNO3 |
| Exact Mass | 443.086284 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5N8OykrXkyN |
|---|---|
| Name | 6-bromo-3-butyl-7-hydroxy-4-methyl-8-(piperidinomethyl)coumarin, hydrochloride |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H27BrClNO3 |
| InChI | InChI=1S/C20H26BrNO3.ClH/c1-3-4-8-14-13(2)15-11-17(21)18(23)16(19(15)25-20(14)24)12-22-9-6-5-7-10-22;/h11,23H,3-10,12H2,1-2H3;1H |
| InChIKey | OBJFIEDXIQZNNQ-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 52680M |
| Solvent | CDCl3 |