| SpectraBase Compound ID | FSlmce9vhK0 |
|---|---|
| InChI | InChI=1S/C9H11ClN4O2/c1-12-7-6(8(15)13(2)9(12)16)14(4-3-10)5-11-7/h5H,3-4H2,1-2H3 |
| InChIKey | QCIARNIKNKKHFH-UHFFFAOYSA-N |
| Mol Weight | 242.67 g/mol |
| Molecular Formula | C9H11ClN4O2 |
| Exact Mass | 242.057053 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 1JQCmkaBYFj |
|---|---|
| Name | 7-Chloroethyl-theophylline |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H11ClN4O2 |
| InChI | InChI=1S/C9H11ClN4O2/c1-12-7-6(8(15)13(2)9(12)16)14(4-3-10)5-11-7/h5H,3-4H2,1-2H3 |
| InChIKey | QCIARNIKNKKHFH-UHFFFAOYSA-N |
| Instrument Name | Bruker AC-200 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |