| SpectraBase Compound ID | KKFlpdLlFYj |
|---|---|
| InChI | InChI=1S/C13H19N5O2/c1-15-11-10(12(19)16(2)13(15)20)18(8-14-11)9-17-6-4-3-5-7-17/h8H,3-7,9H2,1-2H3 |
| InChIKey | PDJBQTXZAKKRHR-UHFFFAOYSA-N |
| Mol Weight | 277.33 g/mol |
| Molecular Formula | C13H19N5O2 |
| Exact Mass | 277.153875 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ePeNwL4g8v |
|---|---|
| Name | 7-(piperidinomethyl)theophylline |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H19N5O2 |
| InChI | InChI=1S/C13H19N5O2/c1-15-11-10(12(19)16(2)13(15)20)18(8-14-11)9-17-6-4-3-5-7-17/h8H,3-7,9H2,1-2H3 |
| InChIKey | PDJBQTXZAKKRHR-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 31289M |
| Solvent | CDCl3 |