![3-butyl-7-hydroxy-4-methyl-8-[(4-methylpiperidino)methyl]coumarin, hydrobromide](/api/spectrum/38asLa4OkwP/structure.png?h=300&w=458 "3-butyl-7-hydroxy-4-methyl-8-[(4-methylpiperidino)methyl]coumarin, hydrobromide")
| SpectraBase Compound ID | 2MZIYSGlEZh |
|---|---|
| InChI | InChI=1S/C21H29NO3.BrH/c1-4-5-6-17-15(3)16-7-8-19(23)18(20(16)25-21(17)24)13-22-11-9-14(2)10-12-22;/h7-8,14,23H,4-6,9-13H2,1-3H3;1H |
| InChIKey | PFQVBJDZVALIIK-UHFFFAOYSA-N |
| Mol Weight | 424.38 g/mol |
| Molecular Formula | C21H30BrNO3 |
| Exact Mass | 423.140907 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 38asLa4OkwP |
|---|---|
| Name | 3-butyl-7-hydroxy-4-methyl-8-[(4-methylpiperidino)methyl]coumarin, hydrobromide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H30BrNO3 |
| InChI | InChI=1S/C21H29NO3.BrH/c1-4-5-6-17-15(3)16-7-8-19(23)18(20(16)25-21(17)24)13-22-11-9-14(2)10-12-22;/h7-8,14,23H,4-6,9-13H2,1-3H3;1H |
| InChIKey | PFQVBJDZVALIIK-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 52700M |
| Solvent | Polysol |