![7-{3-[4-(p-fluorobenzoyl)piperidino]propyl]theophylline](/api/spectrum/4bw1X0TrKaR/structure.png?h=300&w=458 "7-{3-[4-(p-fluorobenzoyl)piperidino]propyl]theophylline")
| SpectraBase Compound ID | 9QfnoqnlJ3n |
|---|---|
| InChI | InChI=1S/C22H26FN5O3/c1-25-20-18(21(30)26(2)22(25)31)28(14-24-20)11-3-10-27-12-8-16(9-13-27)19(29)15-4-6-17(23)7-5-15/h4-7,14,16H,3,8-13H2,1-2H3 |
| InChIKey | IPSYNNODBHPDFB-UHFFFAOYSA-N |
| Mol Weight | 427.48 g/mol |
| Molecular Formula | C22H26FN5O3 |
| Exact Mass | 427.201968 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4bw1X0TrKaR |
|---|---|
| Name | 7-{3-[4-(p-fluorobenzoyl)piperidino]propyl]theophylline |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H26FN5O3 |
| InChI | InChI=1S/C22H26FN5O3/c1-25-20-18(21(30)26(2)22(25)31)28(14-24-20)11-3-10-27-12-8-16(9-13-27)19(29)15-4-6-17(23)7-5-15/h4-7,14,16H,3,8-13H2,1-2H3 |
| InChIKey | IPSYNNODBHPDFB-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 44155M |
| Solvent | CDCl3 |