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2H-1-Benzopyran-2-one, 5,6,7-trimethoxy-4-(3-quinolinyl)-

View entire compound with spectra: 1 NMR, and 2 MS (GC)

2H-1-Benzopyran-2-one, 5,6,7-trimethoxy-4-(3-quinolinyl)-
SpectraBase Compound ID IrJWz32jrrC
InChI InChI=1S/C21H17NO5/c1-24-17-10-16-19(21(26-3)20(17)25-2)14(9-18(23)27-16)13-8-12-6-4-5-7-15(12)22-11-13/h4-11H,1-3H3
InChIKey OZTXTSRRQXXPAX-UHFFFAOYSA-N
Mol Weight 363.37 g/mol
Molecular Formula C21H17NO5
Exact Mass 363.110673 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AztSr53WR6g
Name 2H-1-Benzopyran-2-one, 5,6,7-trimethoxy-4-(3-quinolinyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 363.110672646 u
Formula C21H17NO5
InChI InChI=1S/C21H17NO5/c1-24-17-10-16-19(21(26-3)20(17)25-2)14(9-18(23)27-16)13-8-12-6-4-5-7-15(12)22-11-13/h4-11H,1-3H3
InChIKey OZTXTSRRQXXPAX-UHFFFAOYSA-N
Molecular Weight 363.369 g/mol
SMILES C=1(C(=CC2=C(C1OC)C(=CC(O2)=O)C=1C=C2C(=NC1)C=CC=C2)OC)OC