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(5-Methoxy-8,8-dimethyl-4,8-dihydro-4-oxo-1H-pyrano[2,3-h]quinolin-3-yl)carboxylic acid
SpectraBase Compound ID 2Ju9p77Wi2E
InChI InChI=1S/C16H15NO5/c1-16(2)5-4-8-10(22-16)6-11(21-3)12-13(8)17-7-9(14(12)18)15(19)20/h4-7H,1-3H3,(H,17,18)(H,19,20)
InChIKey GIMDECSYEGMUGC-UHFFFAOYSA-N
Mol Weight 301.3 g/mol
Molecular Formula C16H15NO5
Exact Mass 301.095023 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DtOz95zGbE9
Name (5-Methoxy-8,8-dimethyl-4,8-dihydro-4-oxo-1H-pyrano[2,3-H]quinolin-3-yl)carboxylic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 301.095022582 u
Formula C16H15NO5
InChI InChI=1S/C16H15NO5/c1-16(2)5-4-8-10(22-16)6-11(21-3)12-13(8)17-7-9(14(12)18)15(19)20/h4-7H,1-3H3,(H,17,18)(H,19,20)
InChIKey GIMDECSYEGMUGC-UHFFFAOYSA-N
SMILES C1=2C(C(C(=O)O)=CNC2C=2C=CC(OC2C=C1OC)(C)C)=O