| SpectraBase Compound ID | IRTh5bS7xld |
|---|---|
| InChI | InChI=1S/C13H21N2O.HI/c1-5-15(6-2)13-10-12(11(3)16)8-7-9-14(13)4;/h7-9H,5-6,10H2,1-4H3;1H/q+1;/p-1 |
| InChIKey | HUWNHBSBCKDSRV-UHFFFAOYSA-M |
| Mol Weight | 348.22847 g/mol |
| Molecular Formula | C13H21IN2O |
| Exact Mass | 348.069858 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 890q4p3wAh |
|---|---|
| Name | 4-acetyl-2-(diethylamino)-1-methyl-3H-azepinium iodide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H21IN2O |
| InChI | InChI=1S/C13H21N2O.HI/c1-5-15(6-2)13-10-12(11(3)16)8-7-9-14(13)4;/h7-9H,5-6,10H2,1-4H3;1H/q+1;/p-1 |
| InChIKey | HUWNHBSBCKDSRV-UHFFFAOYSA-M |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 22266M |
| Solvent | Polysol |