| SpectraBase Compound ID | KQDxgZzWKgi |
|---|---|
| InChI | InChI=1S/C17H27NO2/c1-6-9-15-10-7-8-11-17(15)20-13-16(19-5)12-18(4)14(2)3/h6-8,10-11,14,16H,1,9,12-13H2,2-5H3 |
| InChIKey | CPMWAIVHOZZHFS-UHFFFAOYSA-N |
| Mol Weight | 277.41 g/mol |
| Molecular Formula | C17H27NO2 |
| Exact Mass | 277.204179 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CeAQguOulio |
|---|---|
| Name | Alprenolol, N-methyl-, methyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.204179111 u |
| Formula | C17H27NO2 |
| InChI | InChI=1S/C17H27NO2/c1-6-9-15-10-7-8-11-17(15)20-13-16(19-5)12-18(4)14(2)3/h6-8,10-11,14,16H,1,9,12-13H2,2-5H3 |
| InChIKey | CPMWAIVHOZZHFS-UHFFFAOYSA-N |
| Molecular Weight | 277.408 g/mol |
| SMILES | C1(=CC=CC=C1CC=C)OCC(CN(C(C)C)C)OC |