![7-{2-[(1,1-dimethyl-2-hydroxyethyl)amino]ethyl}theophylline acetate (ester)](/api/spectrum/7WRCr10zyLU/structure.png?h=300&w=458 "7-{2-[(1,1-dimethyl-2-hydroxyethyl)amino]ethyl}theophylline acetate (ester)")
| SpectraBase Compound ID | 7J71kvzGCtT |
|---|---|
| InChI | InChI=1S/C15H23N5O4/c1-10(21)24-8-15(2,3)17-6-7-20-9-16-12-11(20)13(22)19(5)14(23)18(12)4/h9,17H,6-8H2,1-5H3 |
| InChIKey | FVNCZGILGOJHIY-UHFFFAOYSA-N |
| Mol Weight | 337.38 g/mol |
| Molecular Formula | C15H23N5O4 |
| Exact Mass | 337.175004 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7WRCr10zyLU |
|---|---|
| Name | 7-{2-[(1,1-dimethyl-2-hydroxyethyl)amino]ethyl}theophylline acetate (ester) |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H23N5O4 |
| InChI | InChI=1S/C15H23N5O4/c1-10(21)24-8-15(2,3)17-6-7-20-9-16-12-11(20)13(22)19(5)14(23)18(12)4/h9,17H,6-8H2,1-5H3 |
| InChIKey | FVNCZGILGOJHIY-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 49750M |
| Solvent | CDCl3 |