![7-{2-[(1,1-dimethyl-2-hydroxyethyl)amino]ethyl}theophylline](/api/spectrum/2SSZuW5j5WG/structure.png?h=300&w=458 "7-{2-[(1,1-dimethyl-2-hydroxyethyl)amino]ethyl}theophylline")
| SpectraBase Compound ID | 48RYZfMYkHi |
|---|---|
| InChI | InChI=1S/C13H21N5O3/c1-13(2,7-19)15-5-6-18-8-14-10-9(18)11(20)17(4)12(21)16(10)3/h8,15,19H,5-7H2,1-4H3 |
| InChIKey | NUTPPCLCXFGERD-UHFFFAOYSA-N |
| Mol Weight | 295.34 g/mol |
| Molecular Formula | C13H21N5O3 |
| Exact Mass | 295.16444 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2SSZuW5j5WG |
|---|---|
| Name | 7-{2-[(1,1-dimethyl-2-hydroxyethyl)amino]ethyl}theophylline |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H21N5O3 |
| InChI | InChI=1S/C13H21N5O3/c1-13(2,7-19)15-5-6-18-8-14-10-9(18)11(20)17(4)12(21)16(10)3/h8,15,19H,5-7H2,1-4H3 |
| InChIKey | NUTPPCLCXFGERD-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 49744M |
| Solvent | Polysol |