![4-[2-(allylphenethylamino)ethyl]pyrocatechol, fumarate(1:1)(salt)](/api/spectrum/B4MZehf5cEY/structure.png?h=300&w=458 "4-[2-(allylphenethylamino)ethyl]pyrocatechol, fumarate(1:1)(salt)")
| SpectraBase Compound ID | JWYHtXx0UDv |
|---|---|
| InChI | InChI=1S/C19H23NO2.C4H4O4/c1-2-12-20(13-10-16-6-4-3-5-7-16)14-11-17-8-9-18(21)19(22)15-17;5-3(6)1-2-4(7)8/h2-9,15,21-22H,1,10-14H2;1-2H,(H,5,6)(H,7,8)/b;2-1+ |
| InChIKey | YRNDOMLVAJHMLG-WLHGVMLRSA-N |
| Mol Weight | 413.47 g/mol |
| Molecular Formula | C23H27NO6 |
| Exact Mass | 413.183838 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B4MZehf5cEY |
|---|---|
| Name | 4-[2-(allylphenethylamino)ethyl]pyrocatechol, fumarate(1:1)(salt) |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H27NO6 |
| InChI | InChI=1S/C19H23NO2.C4H4O4/c1-2-12-20(13-10-16-6-4-3-5-7-16)14-11-17-8-9-18(21)19(22)15-17;5-3(6)1-2-4(7)8/h2-9,15,21-22H,1,10-14H2;1-2H,(H,5,6)(H,7,8)/b;2-1+ |
| InChIKey | YRNDOMLVAJHMLG-WLHGVMLRSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 35113M |
| Solvent | Polysol |