![N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-phenylsulfanylethylamine](/api/spectrum/F9KsjPzuB1l/structure.png?h=300&w=458 "N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-phenylsulfanylethylamine")
| SpectraBase Compound ID | 3msO4phV4X7 |
|---|---|
| InChI | InChI=1S/C18H23NO2S/c1-20-17-9-8-15(14-18(17)21-2)10-11-19-12-13-22-16-6-4-3-5-7-16/h3-9,14,19H,10-13H2,1-2H3 |
| InChIKey | GYDDHWUJVQKFLP-UHFFFAOYSA-N |
| Mol Weight | 317.45 g/mol |
| Molecular Formula | C18H23NO2S |
| Exact Mass | 317.14495 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F9KsjPzuB1l |
|---|---|
| Name | N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-phenylsulfanylethylamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 317.144950157 u |
| Formula | C18H23NO2S |
| InChI | InChI=1S/C18H23NO2S/c1-20-17-9-8-15(14-18(17)21-2)10-11-19-12-13-22-16-6-4-3-5-7-16/h3-9,14,19H,10-13H2,1-2H3 |
| InChIKey | GYDDHWUJVQKFLP-UHFFFAOYSA-N |
| Molecular Weight | 317.447 g/mol |
| SMILES | C=1(C(=CC=C(C1)CCNCCSC1=CC=CC=C1)OC)OC |