![L-7-{2-[(b-hydroxy-a-methylphenethyl)amino]ethyl}theophylline, monohydrochloride](/api/spectrum/7YAIAfeP78B/structure.png?h=300&w=458 "L-7-{2-[(b-hydroxy-a-methylphenethyl)amino]ethyl}theophylline, monohydrochloride")
| SpectraBase Compound ID | 7hmWAaCPMeI |
|---|---|
| InChI | InChI=1S/C18H23N5O3.ClH/c1-12(15(24)13-7-5-4-6-8-13)19-9-10-23-11-20-16-14(23)17(25)22(3)18(26)21(16)2;/h4-8,11-12,15,19,24H,9-10H2,1-3H3;1H |
| InChIKey | UTTZHZDGHMJDPM-UHFFFAOYSA-N |
| Mol Weight | 393.88 g/mol |
| Molecular Formula | C18H24ClN5O3 |
| Exact Mass | 393.156767 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7YAIAfeP78B |
|---|---|
| Name | L-7-{2-[(b-hydroxy-a-methylphenethyl)amino]ethyl}theophylline, monohydrochloride |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H24ClN5O3 |
| InChI | InChI=1S/C18H23N5O3.ClH/c1-12(15(24)13-7-5-4-6-8-13)19-9-10-23-11-20-16-14(23)17(25)22(3)18(26)21(16)2;/h4-8,11-12,15,19,24H,9-10H2,1-3H3;1H |
| InChIKey | UTTZHZDGHMJDPM-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 28808M |
| Solvent | Polysol |