| SpectraBase Compound ID | 21DvaC5bGuY |
|---|---|
| InChI | InChI=1S/C15H24BrNO2/c1-5-8-17(6-2)9-7-12-10-14(18-3)15(19-4)11-13(12)16/h10-11H,5-9H2,1-4H3 |
| InChIKey | JCQXIILTZAUPRP-UHFFFAOYSA-N |
| Mol Weight | 330.27 g/mol |
| Molecular Formula | C15H24BrNO2 |
| Exact Mass | 329.099042 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IzgTS9DWXku |
|---|---|
| Name | N,N-Ethyl-propyl-2-bromo-4,5-dimethoxyphenethylamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 329.099042015 u |
| Formula | C15H24BrNO2 |
| InChI | InChI=1S/C15H24BrNO2/c1-5-8-17(6-2)9-7-12-10-14(18-3)15(19-4)11-13(12)16/h10-11H,5-9H2,1-4H3 |
| InChIKey | JCQXIILTZAUPRP-UHFFFAOYSA-N |
| Molecular Weight | 330.266 g/mol |
| SMILES | C=1(C(=CC(=C(C1)OC)OC)Br)CCN(CCC)CC |