| SpectraBase Compound ID | BrHBOu1PING |
|---|---|
| InChI | InChI=1S/C18H23NO2/c1-14-5-4-6-16(11-14)13-19-10-9-15-7-8-17(20-2)18(12-15)21-3/h4-8,11-12,19H,9-10,13H2,1-3H3 |
| InChIKey | WNAXZTIJDZFQLU-UHFFFAOYSA-N |
| Mol Weight | 285.39 g/mol |
| Molecular Formula | C18H23NO2 |
| Exact Mass | 285.172879 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Asdwi98nWhr |
|---|---|
| Name | 2-(3,4-Dimethoxyphenyl)-N-(3-methylbenzyl)ethan-1-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.172878983 u |
| Formula | C18H23NO2 |
| InChI | InChI=1S/C18H23NO2/c1-14-5-4-6-16(11-14)13-19-10-9-15-7-8-17(20-2)18(12-15)21-3/h4-8,11-12,19H,9-10,13H2,1-3H3 |
| InChIKey | WNAXZTIJDZFQLU-UHFFFAOYSA-N |
| SMILES | C=1(C(=CC=C(C1)CCNCC1=CC(=CC=C1)C)OC)OC |