| SpectraBase Compound ID | 6WSH783A45N |
|---|---|
| InChI | InChI=1S/C15H17NO3S/c1-19-15-10-6-5-9-14(15)16-11-12-20(17,18)13-7-3-2-4-8-13/h2-10,16H,11-12H2,1H3 |
| InChIKey | VEXKEMTTZVKUED-UHFFFAOYSA-N |
| Mol Weight | 291.36 g/mol |
| Molecular Formula | C15H17NO3S |
| Exact Mass | 291.092915 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KnYzZiu4u2B |
|---|---|
| Name | 2-Methoxy-N-(2-phenylsulfonylethyl)aniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.092914582 u |
| Formula | C15H17NO3S |
| InChI | InChI=1S/C15H17NO3S/c1-19-15-10-6-5-9-14(15)16-11-12-20(17,18)13-7-3-2-4-8-13/h2-10,16H,11-12H2,1H3 |
| InChIKey | VEXKEMTTZVKUED-UHFFFAOYSA-N |
| SMILES | C=1(NCCS(=O)(=O)C=2C=CC=CC2)C(=CC=CC1)OC |