![Methyl 1,4,5,6,7,8-hexahydro-2-methyl-4-[2'-furyl]-5-oxoquinoline-3-carrboxylate](/api/spectrum/A5tQoNcVigz/structure.png?h=300&w=458 "Methyl 1,4,5,6,7,8-hexahydro-2-methyl-4-[2'-furyl]-5-oxoquinoline-3-carrboxylate")
| SpectraBase Compound ID | 3DNhrxKNJK9 |
|---|---|
| InChI | InChI=1S/C16H17NO4/c1-9-13(16(19)20-2)15(12-7-4-8-21-12)14-10(17-9)5-3-6-11(14)18/h4,7-8,15,17H,3,5-6H2,1-2H3 |
| InChIKey | HBVUVQDRXYSKDB-UHFFFAOYSA-N |
| Mol Weight | 287.31 g/mol |
| Molecular Formula | C16H17NO4 |
| Exact Mass | 287.115758 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A5tQoNcVigz |
|---|---|
| Name | Methyl 1,4,5,6,7,8-hexahydro-2-methyl-4-[2'-furyl]-5-oxoquinoline-3-carrboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.115758027 u |
| Formula | C16H17NO4 |
| InChI | InChI=1S/C16H17NO4/c1-9-13(16(19)20-2)15(12-7-4-8-21-12)14-10(17-9)5-3-6-11(14)18/h4,7-8,15,17H,3,5-6H2,1-2H3 |
| InChIKey | HBVUVQDRXYSKDB-UHFFFAOYSA-N |
| SMILES | C=1(C(C=2C(=O)CCCC2NC1C)C=1OC=CC1)C(=O)OC |