| SpectraBase Compound ID | HwdeygjjrVd |
|---|---|
| InChI | InChI=1S/C12H15N3O/c1-9(16)14-12(13)15-7-6-10-4-2-3-5-11(10)8-15/h2-5H,6-8H2,1H3,(H2,13,14,16) |
| InChIKey | JMPMKXPYLSMONL-UHFFFAOYSA-N |
| Mol Weight | 217.27 g/mol |
| Molecular Formula | C12H15N3O |
| Exact Mass | 217.121512 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ByDw2lOq8qT |
|---|---|
| Name | Debrisoquin, N-(acetyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.121512114 u |
| Formula | C12H15N3O |
| InChI | InChI=1S/C12H15N3O/c1-9(16)14-12(13)15-7-6-10-4-2-3-5-11(10)8-15/h2-5H,6-8H2,1H3,(H2,13,14,16) |
| InChIKey | JMPMKXPYLSMONL-UHFFFAOYSA-N |
| Molecular Weight | 217.272 g/mol |
| SMILES | C1=CC=C2C(=C1)CN(CC2)C(NC(C)=O)=N |