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XYRIDIN-B;3-(1-OXO-PROPYL)-6,7-(METHYLENEDIOXY)-ISOCOUMARIN
SpectraBase Compound ID JQI03fM6v9B
InChI InChI=1S/C13H10O5/c1-2-9(14)10-3-7-4-11-12(17-6-16-11)5-8(7)13(15)18-10/h3-5H,2,6H2,1H3
InChIKey QUGCGRKJBDNHBP-UHFFFAOYSA-N
Mol Weight 246.22 g/mol
Molecular Formula C13H10O5
Exact Mass 246.052823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AOnH5JrmGHa
Name XYRIDIN-A;3-(1'-OXOPROPYL)-6,7-(METHYLENEDIOXY)-1H-2-BENZOPYRAN-1-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H10O5
InChI InChI=1S/C13H10O5/c1-2-9(14)10-3-7-4-11-12(17-6-16-11)5-8(7)13(15)18-10/h3-5H,2,6H2,1H3
InChIKey QUGCGRKJBDNHBP-UHFFFAOYSA-N
Literature Reference Author N.RUANGRUNGSI,T.SEKINE,T.OHADUNGCHAROEN,S.SURIYAGAN,I.MURAKO SHI
Literature Reference Citation PHYTOCHEM.,38,481(1995)
Literature Reference DOI 10.1016/0031-9422(94)00714-5
Molecular Weight 246.219 g/mol
Solvent CDCl3
Source File Reference UWMS4814