![2-Methyl-3-N-heptyl-6,7-methylenedioxy-4[1H]-quinolinone](/api/spectrum/6t2lHosMwh5/structure.png?h=300&w=458 "2-Methyl-3-N-heptyl-6,7-methylenedioxy-4[1H]-quinolinone")
| SpectraBase Compound ID | DxASZH4LITk |
|---|---|
| InChI | InChI=1S/C18H23NO3/c1-3-4-5-6-7-8-13-12(2)19-15-10-17-16(21-11-22-17)9-14(15)18(13)20/h9-10H,3-8,11H2,1-2H3,(H,19,20) |
| InChIKey | AGYNYTVJFWXPIC-UHFFFAOYSA-N |
| Mol Weight | 301.39 g/mol |
| Molecular Formula | C18H23NO3 |
| Exact Mass | 301.167794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6t2lHosMwh5 |
|---|---|
| Name | 2-Methyl-3-N-heptyl-6,7-methylenedioxy-4[1H]-quinolinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.167793602 u |
| Formula | C18H23NO3 |
| InChI | InChI=1S/C18H23NO3/c1-3-4-5-6-7-8-13-12(2)19-15-10-17-16(21-11-22-17)9-14(15)18(13)20/h9-10H,3-8,11H2,1-2H3,(H,19,20) |
| InChIKey | AGYNYTVJFWXPIC-UHFFFAOYSA-N |
| SMILES | C12=C(C=C3C(=C2)OCO3)C(C(=C(N1)C)CCCCCCC)=O |