![4-[2-(ethylphenethylamino)ethyl]pyrocatechol, oxalate (2:1) (salt)](/api/spectrum/5dxR8ssiJ3i/structure.png?h=300&w=458 "4-[2-(ethylphenethylamino)ethyl]pyrocatechol, oxalate (2:1) (salt)")
| SpectraBase Compound ID | YmRYy3mqSE |
|---|---|
| InChI | InChI=1S/2C18H23NO2.C2H2O4/c2*1-2-19(12-10-15-6-4-3-5-7-15)13-11-16-8-9-17(20)18(21)14-16;3-1(4)2(5)6/h2*3-9,14,20-21H,2,10-13H2,1H3;(H,3,4)(H,5,6) |
| InChIKey | GHSMPBHPRICWET-UHFFFAOYSA-N |
| Mol Weight | 330.4 g/mol |
| Molecular Formula | C18H23NO2·½C2H2O4 |
| Exact Mass | 330.170533 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5dxR8ssiJ3i |
|---|---|
| Name | 4-[2-(ethylphenethylamino)ethyl]pyrocatechol, oxalate (2:1) (salt) |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H25NO6 |
| InChI | InChI=1S/2C18H23NO2.C2H2O4/c2*1-2-19(12-10-15-6-4-3-5-7-15)13-11-16-8-9-17(20)18(21)14-16;3-1(4)2(5)6/h2*3-9,14,20-21H,2,10-13H2,1H3;(H,3,4)(H,5,6) |
| InChIKey | GHSMPBHPRICWET-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 35855M |
| Solvent | DMSO-d6 |