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SESCANDELIN;6,8-DIHYDROXY-4-(1-HYDROXYETHYL)-ISOCOUMARIN
SpectraBase Compound ID J0QMVY4k4Fm
InChI InChI=1S/C11H10O5/c1-5(12)8-4-16-11(15)10-7(8)2-6(13)3-9(10)14/h2-5,12-14H,1H3
InChIKey QFIOPJBPPBDOEP-UHFFFAOYSA-N
Mol Weight 222.2 g/mol
Molecular Formula C11H10O5
Exact Mass 222.052823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5lOFaiXaM1i
Name SESCANDELIN;6,8-DIHYDROXY-4-(1-HYDROXYETHYL)-ISOCOUMARIN
Compound Number 1
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H10O5
InChI InChI=1S/C11H10O5/c1-5(12)8-4-16-11(15)10-7(8)2-6(13)3-9(10)14/h2-5,12-14H,1H3
InChIKey QFIOPJBPPBDOEP-UHFFFAOYSA-N
Literature Reference Author Y.KIMURA,H.NAKAJIMA,T.HAMASAKI
Literature Reference Citation AGR.BIOL.CHEM.,54,2477(1990)
Literature Reference DOI 10.1271/bbb1961.54.2477
Molecular Weight 222.197 g/mol
Solvent CDCl3
Source File Reference UWBT7986